3-Methylbenzyl cyanide
- Product Name3-Methylbenzyl cyanide
- CAS2947-60-6
- MFC9H9N
- MW131.17
- EINECS220-962-7
- MOL File2947-60-6.mol
Chemical Properties
Boiling point | 240-241 °C(lit.) |
Density | 1.002 g/mL at 25 °C(lit.) |
refractive index | n |
Flash point | >230 °F |
storage temp. | Sealed in dry,Room Temperature |
form | clear liquid |
color | Colorless to Light orange to Yellow |
Specific Gravity | 1.002 |
Water Solubility | INSOLUBLE |
BRN | 1099644 |
Exposure limits | NIOSH: IDLH 25 mg/m3 |
InChI | InChI=1S/C9H9N/c1-8-3-2-4-9(7-8)5-6-10/h2-4,7H,5H2,1H3 |
InChIKey | WOJADIOTNFDWNQ-UHFFFAOYSA-N |
SMILES | C1(CC#N)=CC=CC(C)=C1 |
CAS DataBase Reference | 2947-60-6(CAS DataBase Reference) |
NIST Chemistry Reference | 3-Tolylacetic acid nitrile(2947-60-6) |
Safety Information
Hazard Codes | Xn |
Risk Statements | 20/21/22-36/37/38 |
Safety Statements | 26-37/39-36/37 |
RIDADR | UN 3276 6.1/PG 3 |
WGK Germany | 3 |
HazardClass | 6.1 |
PackingGroup | III |
HS Code | 29269090 |