111-40-0

Name Diethylenetriamine
CAS 111-40-0
EINECS(EC#) 203-865-4
Molecular Formula C4H13N3
MDL Number MFCD00008171
Molecular Weight 103.17
MOL File 111-40-0.mol

Chemical Properties

Appearance colourless liquid
Melting point  -40 °C
Boiling point  206 °C
density  0.955 g/mL at 25 °C(lit.)
vapor density  3.6 (vs air)
vapor pressure  0.08 mm Hg ( 20 °C)
refractive index  n20/D 1.484(lit.)
Fp  90 °C
storage temp.  Store below +30°C.
solubility  Chloroform (Soluble), Methanol (Slightly)
form  Liquid
pka pK1:4.42(+3);pK2:9.21(+2);pK3:10.02(+1) (25°C)
color  Clear
Odor Strong ammoniacal; mildly ammoniacal.
PH >12 (100g/l, H2O, 20℃)
Stability: Stable, but absorbs carbon dioxide from the air. Incompatible with strong oxidizing agents, copper and its alloys.
explosive limit 1-10%(V)
Water Solubility  miscible
Specific Heat Capacity Cp(liquid):254J/(g·K),at 25℃
Sensitive  Air Sensitive
BRN  605314
Henry's Law Constant 9.9×108 mol/(m3Pa) at 25℃, HSDB (2015)
Exposure limits ACGIH: TWA 1 ppm (Skin)
NIOSH: TWA 1 ppm(4 mg/m3)
InChI 1S/C4H13N3/c5-1-3-7-4-2-6/h7H,1-6H2
Contact allergens
Diethylenetriamine is a hardener in epoxy resins of the Bisphenol A type. It has been reported to be a sensitizer when used in an ultrasonic bath for cleaning jewels, in synthetic lubricants, or in carbonless copy paper.
InChIKey RPNUMPOLZDHAAY-UHFFFAOYSA-N
SMILES NCCNCCN
LogP -1.58 at 20℃
CAS DataBase Reference 111-40-0(CAS DataBase Reference)
NIST Chemistry Reference 1,2-Ethanediamine, N-(2-aminoethyl)-(111-40-0)
EPA Substance Registry System 111-40-0(EPA Substance)

Safety Data

Symbol(GHS)  Corrosion (GHS05)Skull and Crossbones (GHS06)
GHS05,GHS06
Signal word  Danger
Hazard statements  H302+H312-H314-H317-H330-H335
Precautionary statements  P260-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
Hazard Codes  C
Risk Statements 
R21/22:Harmful in contact with skin and if swallowed .
R34:Causes burns.
R43:May cause sensitization by skin contact.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
OEB B
OEL TWA: 1 ppm (4 mg/m3) [skin]
RIDADR  UN 2079 8/PG 2
WGK Germany  2
RTECS  IE1225000
Autoignition Temperature 676 °F
TSCA  Yes
REACH Registrations Active
HazardClass  8
PackingGroup  II
HS Code  29212900
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 2 Inhalation
Acute Tox. 4 Dermal
Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B
Skin Sens. 1B
STOT SE 3
Safety Profile
Poison by skin contact and intraperitoneal routes. Moderately toxic by ingestion. Corrosive. A severe skin and eye irritant. High concentration of vapors causes irritation of respiratory tract, nausea, and vomiting. Repeated exposures can cause asthma and sensitization of skin. Combus uble when exposed to heat or flame; can react with oxidizing materials. Mxture with nitromethane is a shock-sensitive explosive. Ignites on contact with cellulose nitrate of high surface area. To fight fire, use alcohol foam. When heated to decomposition it emits toxic fumes of NOx. See also AMINES.
Hazardous Substances Data 111-40-0(Hazardous Substances Data)
Toxicity
LD50 orally in Rabbit: 1540 mg/kg

Hazard Information

Material Safety Data Sheet(MSDS)

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