3-Methylbenzyl cyanide

3-Methylbenzyl cyanide Basic information

Product Name:	3-Methylbenzyl cyanide
Synonyms:	3-Methylbenzyl cyanide 98%;m-Xylyl Cyanide;3-Tolylacetonitrile;Benzeneacetonitrile, 3-methyl-;3-METHYLBENZYL CYANIDE;3-METHYLPHENYLACETONITRILE;M-Tolyacetonitrile;3-TOLYLACETONITRILE 97%
CAS:	2947-60-6
MF:	C9H9N
MW:	131.17
EINECS:	220-962-7
Product Categories:	Aromatic Nitriles;Building Blocks;C8 to C9;Chemical Synthesis;Cyanides/Nitriles;Nitrogen Compounds;Organic Building Blocks
Mol File:	2947-60-6.mol

3-Methylbenzyl cyanide Chemical Properties

Boiling point	240-241 °C(lit.)
density	1.002 g/mL at 25 °C(lit.)
refractive index	n20/D 1.52(lit.)
Fp	>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

MSDS Information

3-Methylbenzyl cyanide Usage And Synthesis

Chemical Properties	clear colorless to light yellow liquid
Uses	(3-Methylphenyl)acetonitrile was used as a reactant to synthesize potential non-nucleoside reverse transcriptase inhibitors (NNRTIs) against HIV. It was also used as a reactant to prepare hepatitis C virus inhibitors.

3-Methylbenzyl cyanide Preparation Products And Raw materials

Preparation Products

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