Benzonitrile, 3-chloro-4-methyl-


Chemical Name: Benzonitrile, 3-chloro-4-methyl-
CAS Number: 21423-81-4
Product Number: AG0033NU(AGN-PC-0JLXQ8)
Synonyms:
MDL No:
Molecular Formula: C8H6ClN
Molecular Weight: 151.5929

Identification/Properties


Properties
MP:
45-48 °C(lit.)
BP:
106°C/6mm
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
151.593g/mol
XLogP3:
3.3
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:
Danger
UN#:
1325
Hazard Statements:
H228
Precautionary Statements:
P210
Class:
4.1
Packing Group:

NMR Spectrum


Other Analytical Data


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