Home Halogens 4-chloro-2-(cyclohexylamino)benzonitrile

4-chloro-2-(cyclohexylamino)benzonitrile

CAS No.:
939816-39-4
Catalog Number:
AG01AAO3
Molecular Formula:
C13H15ClN2
Molecular Weight:
234.7246
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Product Description
Catalog Number:
AG01AAO3
Chemical Name:
4-chloro-2-(cyclohexylamino)benzonitrile
CAS Number:
939816-39-4
Molecular Formula:
C13H15ClN2
Molecular Weight:
234.7246
MDL Number:
MFCD12118976
IUPAC Name:
4-chloro-2-(cyclohexylamino)benzonitrile
InChI:
InChI=1S/C13H15ClN2/c14-11-7-6-10(9-15)13(8-11)16-12-4-2-1-3-5-12/h6-8,12,16H,1-5H2
InChI Key:
LQXOZTQPPYEROY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1NC1CCCCC1)Cl
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.092g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.727g/mol
Monoisotopic Mass:
234.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties