Home Nitriles 2-Chloro-6-methylbenzonitrile

2-Chloro-6-methylbenzonitrile

CAS No.:
6575-09-3
Catalog Number:
AG003H0U
Molecular Formula:
C8H6ClN
Molecular Weight:
151.5929
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Product Description
Catalog Number:
AG003H0U
Chemical Name:
2-Chloro-6-methylbenzonitrile
CAS Number:
6575-09-3
Molecular Formula:
C8H6ClN
Molecular Weight:
151.5929
MDL Number:
MFCD00001782
IUPAC Name:
2-chloro-6-methylbenzonitrile
InChI:
InChI=1S/C8H6ClN/c1-6-3-2-4-8(9)7(6)5-10/h2-4H,1H3
InChI Key:
WQWQHJNUHQEGTN-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cccc1Cl
EC Number:
229-499-5
UNII:
41M65JIW54
NSC Number:
80657
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.593g/mol
Monoisotopic Mass:
151.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties