769-68-6

Name 2-PHENYLBUTYRONITRILE
CAS 769-68-6
EINECS(EC#) 212-213-8
Molecular Formula C10H11N
MDL Number MFCD00001876
Molecular Weight 145.2
MOL File 769-68-6.mol
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Chemical Properties

Boiling point  114-115 °C15 mm Hg(lit.)
density  0.974 g/mL at 25 °C(lit.)
refractive index  n20/D 1.5086(lit.)
Fp  221 °F
storage temp.  Refrigerator, under inert atmosphere
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Oil
color  Colourless
Specific Gravity 0.974
InChI 1S/C10H11N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3
InChIKey IZPUPXNVRNBDSW-UHFFFAOYSA-N
SMILES CCC(C#N)c1ccccc1
CAS DataBase Reference 769-68-6(CAS DataBase Reference)
EPA Substance Registry System Benzeneacetonitrile, .alpha.-ethyl- (769-68-6)

Safety Data

Hazard Codes  Xn
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36/37:Wear suitable protective clothing and gloves .
RIDADR  3276
WGK Germany  3
TSCA  Yes
HazardClass  6.1
PackingGroup  III
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral

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