76686-84-5

Name 3-(1H-1,2,4-TRIAZOL-1-YL)PROPANOIC ACID
CAS 76686-84-5
Molecular Formula C5H7N3O2
MDL Number MFCD02932735
Molecular Weight 141.13
MOL File 76686-84-5.mol

Chemical Properties

Melting point  175 °C(Solvent: Water)
Boiling point  375.852±44.00 °C(Press: 760.00 Torr)(predicted)
density  1.424±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
form  solid
pka 3.900±0.10(predicted)
color  White
InChI InChI=1S/C5H7N3O2/c9-5(10)1-2-8-4-6-3-7-8/h3-4H,1-2H2,(H,9,10)
InChIKey KIJGYTNIFKJHJQ-UHFFFAOYSA-N
SMILES N1(CCC(O)=O)C=NC=N1
CAS DataBase Reference 76686-84-5(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P280-P305+P351+P338-P310
Hazard Codes  C,Xi
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  2933998090

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