| Identification | More | [Name]
3-Methylbenzyl cyanide | [CAS]
2947-60-6 | [Synonyms]
3-METHYLBENZYL CYANIDE
3-METHYLPHENYLACETONITRILE
M-METHYLBENZYL CYANIDE
M-METHYLPHENYLACETONITRILE
M-TOLYLACETONITRILE
M-XYLYL CYANIDE
3-Tolylacetonitrile
Benzeneacetonitrile, 3-methyl-
3-Methylbenzyl cyanide~3-Methylphenylacetonitrile
M-Tolyacetonitrile
3-TOLYLACETONITRILE 97%
m-Tolylacetonitrile, 98+%
3-Methylbenzeneacetonitrile | [EINECS(EC#)]
220-962-7 | [Molecular Formula]
C9H9N | [MDL Number]
MFCD00001914 | [Molecular Weight]
131.17 | [MOL File]
2947-60-6.mol |
| Chemical Properties | Back Directory | [Appearance]
clear colorless to light yellow liquid | [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 Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36/37:Wear suitable protective clothing and gloves . | [RIDADR ]
UN 3276 6.1/PG 3
| [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29269090 |
| Hazard Information | Back Directory | [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. |
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