Benzeneacetonitrile, 2-methyl-


Chemical Name: Benzeneacetonitrile, 2-methyl-
CAS Number: 22364-68-7
Product Number: AG003B97(AGN-PC-0CLNGF)
Synonyms:
MDL No:
Molecular Formula: C9H9N
Molecular Weight: 131.1745

Identification/Properties


Properties
BP:
244.0°C
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.5264-1.5284
Computed Properties
Molecular Weight:
131.178g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
131.073g/mol
Monoisotopic Mass:
131.073g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
142
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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