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4-Methylbenzyl cyanide Structure

4-Methylbenzyl cyanide

Chemical Properties

Melting point 18 °C(lit.)
Boiling point 242-243 °C(lit.)
Density  0.992 g/mL at 25 °C(lit.)
refractive index  n20/D 1.519(lit.)
Flash point 223 °F
storage temp.  Inert atmosphere,Room Temperature
form  Liquid
Specific Gravity 0.99
color  Clear colorless to faintly yellow
BRN  1099645
Exposure limits NIOSH: IDLH 25 mg/m3
InChI InChI=1S/C9H9N/c1-8-2-4-9(5-3-8)6-7-10/h2-5H,6H2,1H3
InChIKey RNHKXHKUKJXLAU-UHFFFAOYSA-N
SMILES C1(CC#N)=CC=C(C)C=C1
CAS DataBase Reference 2947-61-7(CAS DataBase Reference)
FDA UNII 5LWN3C33SM
NIST Chemistry Reference Benzeneacetonitrile, 4-methyl-(2947-61-7)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H412
Precautionary statements P273-P501
Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  26-37/39-36/37-24/25
RIDADR  UN 3276 6.1/PG 3
WGK Germany  3
HazardClass  6.1
PackingGroup  III
HS Code  29269095
NFPA 704:
1
2 0

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