Benzeneacetonitrile, 3-chloro-


Chemical Name: Benzeneacetonitrile, 3-chloro-
CAS Number: 1529-41-5
Product Number: AG003JB8(AGN-PC-0JLB5C)
Synonyms:
MDL No:
Molecular Formula: C8H6ClN
Molecular Weight: 151.5929

Identification/Properties


Properties
MP:
11-13 °C(lit.)
BP:
270°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.544(lit.)
Computed Properties
Molecular Weight:
151.593g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
151.019g/mol
Monoisotopic Mass:
151.019g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
147
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


NMR Spectrum


Other Analytical Data


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