6627-91-4

Name 2-(CYANOMETHYL)BENZOIC ACID
CAS 6627-91-4
EINECS(EC#) 229-602-3
Molecular Formula C9H7NO2
MDL Number MFCD00020293
Molecular Weight 161.16
MOL File 6627-91-4.mol
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Chemical Properties

Melting point  126 °C
Boiling point  348.8±17.0 °C(Predicted)
density  1.257±0.06 g/cm3(Predicted)
storage temp.  2-8°C
form  solid
pka 3.66±0.36(Predicted)
InChI 1S/C9H7NO2/c10-6-5-7-3-1-2-4-8(7)9(11)12/h1-4H,5H2,(H,11,12)
InChIKey AGXBHBJDSLZGAP-UHFFFAOYSA-N
SMILES OC(=O)c1ccccc1CC#N
CAS DataBase Reference 6627-91-4(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
WGK Germany  WGK 3
HS Code  2916399090
Storage Class 11 - Combustible Solids

Hazard Information

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