Benzonitrile, 2-chloro-4-methyl-


Chemical Name: Benzonitrile, 2-chloro-4-methyl-
CAS Number: 21423-84-7
Product Number: AG0072E2(AGN-PC-0JOY4T)
Synonyms:
MDL No: MFCD03094672
Molecular Formula: C8H6ClN
Molecular Weight: 151.5929

Identification/Properties


Computed Properties
Molecular Weight:
151.593g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
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:
158
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#:
N/A
Hazard Statements:
H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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