111-42-2 structure, C4H11NO2
Diethanolamine
CAS No.: 111-42-2 Formula: C4H11NO2 Molecular Weight: 105.13600
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Diethanolamine

CAS No.:

111-42-2

Formula:

C4H11NO2

Molecular Weight: 105.13600
Suppliers: All (62) China Suppliers (62) Price Available (13) Contractor (4)

Description

Diethanolamine, often abbreviated as DEA or DEOA, is an organic compound with the formula HN(CH2CH2OH)2. Pure diethanolamine is a white solid at room temperature, but its tendency to absorb water and to supercool mean it is often encountered as a colorless, viscous liquid. Diethanolamine is polyfunctional, being a secondary amine and a diol. Like other organic amines, diethanolamine acts as a weak base. Reflecting the hydrophilic character of the secondary amine and hydroxyl groups, DEA is soluble in water. Amides prepared from DEA are often also hydrophilic.

Basic Info

Chemical Name

Diethanolamine

Synonyms

DEA; 2,2'-Iminodiethanol; Ethanol, 2,2‘-iminobis-; 2,2'-Azanediyldiethanol; bis-(2-hydroxy-ethyl)-amine;

CAS No.

111-42-2

Molecular Formula

C4H11NO2

Molecular Weight

105.13600

PSA

52.49000

LogP

-1.04850

Numbering system

MDL number MFCD00002843
BRN number 605315
RTECS number KL2975000
PubChem number 24894233
EINECS number 203-868-0

Properties

Appearance & Physical State

solid or viscous liquid with an amine odour

Density

1.096

Boiling Point

268ºC

Melting Point

27-30ºC

Flash Point

179ºC

Refractive Index

1.475-1.479

Water Solubility

MISCIBLE

Stability

Stable. Incompatible with carbon dioxide, strong acids, strong oxidizing agents. Deliquescent.

Storage Condition

Store at RT

Vapor Density

3.6 (vs air)

Vapor Pressure

<0.98 atm ( 100 °C)

Safety Info

RTECS

KL2975000

Safety Statements

S26-S36/37/39-S46

HS Code

2922120090

Packing Group

II

WGK Germany

1

RIDADR

UN 1760

Risk Statements

R22; R38; R41; R48/22

Hazard Codes

Xn

Hazard Declaration

H302; H315; H318; H373; H412

Signal Word

Danger

Symbol

GHS05, GHS07, GHS08

Caution Statement

P273; P280; P301 + P312 + P330; P305 + P351 + P338 + P310

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SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 10, 2017

Revision Date: Aug 10, 2017

1.Identification

1.1 GHS Product identifier

Product name Diethanolamine

1.2 Other means of identification

Product number -
Other names DEA

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Diethanolamine is used in cutting oils, soaps, shampoos, cleaners, polishers, cosmetics, and pharmaceuticals. It is also used as an intermediate in the rubber chemicals industry, as a humectant and softening agent, and as an emulsifier and dispersing agent in various agricultural chemicals.
Uses advised against no data available

1.4 Supplier's details

Company MOLBASE (Shanghai) Biotechnology Co., Ltd.
Address Floor 4 & 5, Building 12, No. 1001 North Qinzhou Road,
Xuhui District, Shanghai, China
Telephone +86(21)64956998
Fax +86(21)54365166

1.5 Emergency phone number

Emergency phone number +86-400-6021-666
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Skin irritation, Category 2

Serious eye damage, Category 1

Specific target organ toxicity – repeated exposure, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H302 Harmful if swallowed

H315 Causes skin irritation

H318 Causes serious eye damage

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/…if you feel unwell.

P330 Rinse mouth.

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P310 Immediately call a POISON CENTER/doctor/…

P314 Get medical advice/attention if you feel unwell.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

3.Composition/information on ingredients

3.1 Substances

Chemical name Common names and synonyms CAS number EC number Concentration
Diethanolamine Diethanolamine 111-42-2 none 100%

4.First-aid measures

4.1 Description of necessary first-aid measures

General advice

Consult a physician. Show this safety data sheet to the doctor in attendance.

If inhaled

Fresh air, rest.

In case of skin contact

Remove contaminated clothes. Rinse skin with plenty of water or shower.

In case of eye contact

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

If swallowed

Rinse mouth. Give one or two glasses of water to drink. Refer for medical attention . Rest.

4.2 Most important symptoms/effects, acute and delayed

Irritation of eyes and skin. Breathing vapors may cause coughing, a smothering sensation, nausea, headache. (USCG, 1999)

4.3 Indication of immediate medical attention and special treatment needed, if necessary

Immediate first aid: Ensure that adequate decontamination has been carried out. If patient is not breathing, start artificial respiration, preferably with a demand valve resuscitator, bag-valve-mask device, or pocket mask, as trained. Perform CPR if necessary. Immediately flush contaminated eyes with gently flowing water. Do not induce vomiting. If vomiting occurs, lean patient forward or place on the left side (head-down position, if possible) to maintain an open airway and prevent aspiration. Keep patient quiet and maintain normal body temperature. Obtain medical attention. /Organic bases/Amines and related compounds/

5.Fire-fighting measures

5.1 Extinguishing media

Suitable extinguishing media

Wear self contained breathing apparatus for fire fighting if necessary.

5.2 Specific hazards arising from the chemical

Special Hazards of Combustion Products: Irritating vapors are generated when heated. (USCG, 1999)

5.3 Special protective actions for fire-fighters

Wear self-contained breathing apparatus for firefighting if necessary.

6.Accidental release measures

6.1 Personal precautions, protective equipment and emergency procedures

Use personal protective equipment. Avoid dust formation. Avoid breathing vapours, mist or gas. Ensure adequate ventilation. Evacuate personnel to safe areas. Avoid breathing dust. For personal protection see section 8.

6.2 Environmental precautions

Personal protection: filter respirator for organic gases and particulates adapted to the airborne concentration of the substance. Sweep spilled substance into covered sealable containers. If appropriate, moisten first to prevent dusting. Then store and dispose of according to local regulations.

6.3 Methods and materials for containment and cleaning up

Personal precautions, protective equipment and emergency procedures: Use personal protective equipment. Avoid breathing vapours, mist or gas. Ensure adequate ventilation. Evacuate personnel to safe areas.

7.Handling and storage

7.1 Precautions for safe handling

Avoid contact with skin and eyes. Avoid formation of dust and aerosols. Avoid exposure - obtain special instructions before use.Provide appropriate exhaust ventilation at places where dust is formed. For precautions see section 2.2.

7.2 Conditions for safe storage, including any incompatibilities

Separated from strong oxidants and acids. Dry.Keep container tightly closed in a dry and well-ventilated place. Containers which are opened must be carefully resealed and kept upright to prevent leakage. Air sensitive.

8.Exposure controls/personal protection

8.1 Control parameters

Occupational Exposure limit values

Recommended Exposure Limit: 10 Hour Time-Weighted Average: 3 ppm (15 mg/cu m).

Biological limit values

no data available

8.2 Appropriate engineering controls

Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at the end of workday.

8.3 Individual protection measures, such as personal protective equipment (PPE)

Eye/face protection

Safety glasses with side-shields conforming to EN166. Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).

Skin protection

Wear impervious clothing. The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace. Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique(without touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices. Wash and dry hands. The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the standard EN 374 derived from it.

Respiratory protection

Wear dust mask when handling large quantities.

Thermal hazards

no data available

9.Physical and chemical properties

Physical state solid or viscous liquid with an amine odour
Colour A faintly colored, viscous liquid or deliquescent prisms
Odour Mild, ammonia-like odor
Melting point/ freezing point 255°C(lit.)
Boiling point or initial boiling point and boiling range 217°C/150mmHg(lit.)
Flammability Class IIIB Combustible Liquid: Fl.P. at or above 93.33°C.Combustible SolidCombustible.
Lower and upper explosion limit / flammability limit Lower flammable limit: 1.6% by volume (calculated); Upper flammable limit: 9.8% by volume (estimated)
Flash point 138°C
Auto-ignition temperature 365°C
Decomposition temperature no data available
pH Strong base. pH of 0.1 N aqueous solution: 11.0
Kinematic viscosity 351.9 cP at 30°C; 53.85 cP at 60°C
Solubility In water:MISCIBLE
Partition coefficient n-octanol/water (log value) log Kow= - 1.43
Vapour pressure <0.98 atm ( 100 °C)
Density and/or relative density 1.097g/mLat 25°C(lit.)
Relative vapour density 3.6 (vs air)
Particle characteristics no data available

10.Stability and reactivity

10.1 Reactivity

no data available

10.2 Chemical stability

Stable under recommended storage conditions.

10.3 Possibility of hazardous reactions

Combustile, when exposed to heat or flame; can react with oxidizing materials.The vapour is heavier than air.DIETHANOLAMINE is an aminoalcohol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. This compound is hygroscopic. It may be sensitive to exposure to air and light. This compound can react with oxidizing materials, acids, CO2, copper alloys, aluminum, zinc, galvanized iron and copper.

10.4 Conditions to avoid

no data available

10.5 Incompatible materials

DEA (Diethanolamine) degrades in the presense of carbon dioxide to yield HEOD [3-(2-hydroxy-ethyl)oxazolidone], THEED [N,N,N,'-(2-hydroxyethyl)ethyleen-diamine] and BHEP [N,N'-bis(2-hydroxyethyl)piperazine.

10.6 Hazardous decomposition products

Special hazards arising from the substance or mixture: Carbon oxides, nitrogen oxides (NOx). Nature of decomposition products not known.

11.Toxicological information

Acute toxicity

  • Oral: LD50 Rat oral 710 mg/kg
  • Inhalation: no data available
  • Dermal: no data available

Skin corrosion/irritation

no data available

Serious eye damage/irritation

no data available

Respiratory or skin sensitization

no data available

Germ cell mutagenicity

no data available

Carcinogenicity

Evaluation: Cancer in humans: There is inadequate evidence in humans for the carcinogenicity of diethanolamine. Cancer in experimental animals: There is sufficient evidence in experimental animals for the carcinogenicity of diethanolamine. Overall evaluation: Diethanolamine is possibly carcinogen to humans (Group 2B).

Reproductive toxicity

No information is available on the reproductive or developmental effects of diethanolamine in humans. Animal studies have reported testicular degeneration and reduced sperm motility and count from oral exposure to diethanolamine. (10)

STOT-single exposure

no data available

STOT-repeated exposure

no data available

Aspiration hazard

no data available

12.Ecological information

12.1 Toxicity

  • Toxicity to fish: LC50; Species: Lepomis macrochirus (Bluegill) weight 5 g, length 7 (5-11) cm; Conditions: freshwater, static, 20°C, pH 6.9-7.5, hardness 84.0-163 mg/L CaCO3, alkalinity 33.0-81.0 mg/L CaCO3, dissolved oxygen >5 mg/L; Concentration: 2100000 ug/L for 24 hr /formulation
  • Toxicity to daphnia and other aquatic invertebrates: LC50; Species: Daphnia magna (Water Flea) age < or =24 hr; Conditions: freshwater, static, 20-22°C, pH 7.6-7.7; Concentration: 180000 ug/L for 24 hr /formulation
  • Toxicity to algae: no data available
  • Toxicity to microorganisms: no data available

12.2 Persistence and degradability

AEROBIC: Biodegradation of diethanolamine has been reported in many die-away tests(1-3). N-Nitrosodiethanolamine has been identified as a metabolite of diethanolamine in natural water samples and sewage(2).Media Initial Concn Incubation Time (days) % Biodegradation Reference River Water 21 mg/L 4 5 1 River Water 210 ug/L 4 55 1 River Water 21 ng/L 4 32 1 Lake Water 1.1 ppm 14 31 2 Acidic Lake Water 1.1 ppm 14 1.2 2 Sewage 1.1 ppm 14 53 2 River Water 50 ppm 10 90 3

12.3 Bioaccumulative potential

An estimated BCF of 3 was calculated in fish for diethanolamine(SRC), using a log Kow of -1.43(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is low(SRC).

12.4 Mobility in soil

The Koc of diethanolamine has been reported as 3.97(1) and an experimental log Koc of 0.60(2). According to a classification scheme(3), these Koc values suggest that diethanolamine is expected to have very high mobility in soil. The pKa of diethanolamine is 8.96(4), indicating that this compound will exist partially in cation form in the environment and cations generally adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5). Diethanolamine has been shown to adsorb to humic acid which may be contained in soils and sediments(6). The adsorption of diethanolamine on humic acid changed very slightly from pH 4-8, (40-45% adsorption)(6).

12.5 Other adverse effects

no data available

13.Disposal considerations

13.1 Disposal methods

Product

The material can be disposed of by removal to a licensed chemical destruction plant or by controlled incineration with flue gas scrubbing. Do not contaminate water, foodstuffs, feed or seed by storage or disposal. Do not discharge to sewer systems.

Contaminated packaging

Containers can be triply rinsed (or equivalent) and offered for recycling or reconditioning. Alternatively, the packaging can be punctured to make it unusable for other purposes and then be disposed of in a sanitary landfill. Controlled incineration with flue gas scrubbing is possible for combustible packaging materials.

14.Transport information

14.1 UN Number

ADR/RID: UN3077 IMDG: UN3077 IATA: UN3077

14.2 UN Proper Shipping Name

ADR/RID: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, SOLID, N.O.S.
IMDG: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, SOLID, N.O.S.
IATA: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, SOLID, N.O.S.

14.3 Transport hazard class(es)

ADR/RID: 9 IMDG: 9 IATA: 9

14.4 Packing group, if applicable

ADR/RID: II IMDG: II IATA: II

14.5 Environmental hazards

ADR/RID: no IMDG: no IATA: no

14.6 Special precautions for user

no data available

14.7 Transport in bulk according to Annex II of MARPOL 73/78 and the IBC Code

no data available

15.Regulatory information

15.1 Safety, health and environmental regulations specific for the product in question

Chemical name Common names and synonyms CAS number EC number
Diethanolamine Diethanolamine 111-42-2 none
European Inventory of Existing Commercial Chemical Substances (EINECS) Listed.
EC Inventory Listed.
United States Toxic Substances Control Act (TSCA) Inventory Listed.
China Catalog of Hazardous chemicals 2015 Listed.
New Zealand Inventory of Chemicals (NZIoC) Listed.
Philippines Inventory of Chemicals and Chemical Substances (PICCS) Listed.
Vietnam National Chemical Inventory Listed.
Chinese Chemical Inventory of Existing Chemical Substances (China IECSC) Listed.

16.Other information

Information on revision

Creation Date Aug 10, 2017
Revision Date Aug 10, 2017

Abbreviations and acronyms

  • CAS: Chemical Abstracts Service
  • ADR: European Agreement concerning the International Carriage of Dangerous Goods by Road
  • RID: Regulation concerning the International Carriage of Dangerous Goods by Rail
  • IMDG: International Maritime Dangerous Goods
  • IATA: International Air Transportation Association
  • TWA: Time Weighted Average
  • STEL: Short term exposure limit
  • LC50: Lethal Concentration 50%
  • LD50: Lethal Dose 50%
  • EC50: Effective Concentration 50%

References

  • IPCS - The International Chemical Safety Cards (ICSC), website: http://www.ilo.org/dyn/icsc/showcard.home
  • HSDB - Hazardous Substances Data Bank, website: https://toxnet.nlm.nih.gov/newtoxnet/hsdb.htm
  • IARC - International Agency for Research on Cancer, website: http://www.iarc.fr/
  • eChemPortal - The Global Portal to Information on Chemical Substances by OECD, website: http://www.echemportal.org/echemportal/index?pageID=0&request_locale=en
  • CAMEO Chemicals, website: http://cameochemicals.noaa.gov/search/simple
  • ChemIDplus, website: http://chem.sis.nlm.nih.gov/chemidplus/chemidlite.jsp
  • ERG - Emergency Response Guidebook by U.S. Department of Transportation, website: http://www.phmsa.dot.gov/hazmat/library/erg
  • Germany GESTIS-database on hazard substance, website: http://www.dguv.de/ifa/gestis/gestis-stoffdatenbank/index-2.jsp
  • ECHA - European Chemicals Agency, website: https://echa.europa.eu/

Disclaimer: The above information is believed to be correct but does not purport to be all inclusive and shall be used only as a guide. The information in this document is based on the present state of our knowledge and is applicable to the product with regard to appropriate safety precautions. It does not represent any guarantee of the properties of the product. We as supplier shall not be held liable for any damage resulting from handling or from contact with the above product.

MSDS

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111-42-2 NMR spectrum
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GC Analysis

Total 3 Documents >>
Column type Active phase Temperature (°C) Retention Index (I) Temperature Control Method
Packed PEG-2000 179. 2200. isothermal
Packed PEG-2000 200. 2141. isothermal
Packed PEG-2000 200. 2180. isothermal
Exposure Route Type of Test Species Observed Dose/Duration Toxic Effects
Oral TDLo - Lowest published toxic dose Rodent - rat 52 gm/kg/14D-C 1.Kidney, Ureter, Bladder-other changes in urine composition
2.Blood-normocytic anemia
3.Biochemical-Enzyme inhibition, induction, or change in blood or tissue levels-dehydrogenases
Oral TDLo - Lowest published toxic dose Rodent - rat 8827 mg/kg/13W-C 1.Kidney, Ureter, Bladder-changes in bladder weight
2.Blood-normocytic anemia
3.Related to Chronic Data-changes in testicular weight
Oral TDLo - Lowest published toxic dose Rodent - rat 49 gm/kg/7W-C 1.Liver-other changes
2.Blood-normocytic anemia
3.Related to Chronic Data-death
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