Benzonitrile, 3-(chloromethyl)-


Chemical Name: Benzonitrile, 3-(chloromethyl)-
CAS Number: 64407-07-4
Product Number: AG00IBD2(AGN-PC-0JSAFI)
Synonyms:
MDL No:
Molecular Formula: C8H6ClN
Molecular Weight: 151.5929

Identification/Properties


Properties
MP:
67.0 to 71.0 °C
BP:
260°C(lit.)
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.5660 (estimate)
Computed Properties
Molecular Weight:
151.593g/mol
XLogP3:
2.1
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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