2079-89-2

Name 3-AMINOPROPIONITRILE FUMARATE
CAS 2079-89-2
EINECS(EC#) 218-208-7
Molecular Formula C7H10N2O4
MDL Number MFCD00078321
Molecular Weight 186.17
MOL File 2079-89-2.mol
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Chemical Properties

Appearance WHITE CRYSTALLINE POWDER
Melting point  177 °C (dec.)(lit.)
storage temp.  -20°C
solubility  water: 50 mg/mL, clear, colorless to faintly yellow
form  Crystalline Powder
color  White
biological source synthetic (organic)
Water Solubility  almost transparency
BRN  3573532
InChI 1S/C4H4O4.2C3H6N2/c5-3(6)1-2-4(7)8;2*4-2-1-3-5/h1-2H,(H,5,6)(H,7,8);2*1-2,4H2/b2-1+;;
InChIKey NYMXYZMHOZAPHQ-SEPHDYHBSA-N
SMILES NCCC#N.NCCC#N.OC(=O)\C=C\C(O)=O
CAS DataBase Reference 2079-89-2(CAS DataBase Reference)
EPA Substance Registry System Propanenitrile, 3-amino-, (2E)-2-butenedioate (2:1) (2079-89-2)

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Danger
Hazard statements  H360FD
Precautionary statements  P201-P202-P280-P308+P313-P405-P501
Hazard Codes  T
Risk Statements 
R61:May cause harm to the unborn child.
Safety Statements 
S53:Avoid exposure-obtain special instruction before use .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
WGK Germany  3
RTECS  UG0700000
TSCA  Yes
HS Code  29269095
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Repr. 1B
Safety Profile
Moderately toxic by ingestion and intraperitoneal routes. An experimental teratogen. When heated to decomposition it emits toxic fumes of NO, and CN-. See also NITRILES.
Toxicity
LDLo orl-rat: 800 mg/kg TJADAB 5,33,72

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