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

4-chloro-2-(cyclopentylamino)benzonitrile

CAS No.:
939812-57-4
Catalog Number:
AG01AALF
Molecular Formula:
C12H13ClN2
Molecular Weight:
220.6980
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Product Description
Catalog Number:
AG01AALF
Chemical Name:
4-chloro-2-(cyclopentylamino)benzonitrile
CAS Number:
939812-57-4
Molecular Formula:
C12H13ClN2
Molecular Weight:
220.6980
MDL Number:
MFCD12118942
IUPAC Name:
4-chloro-2-(cyclopentylamino)benzonitrile
InChI:
InChI=1S/C12H13ClN2/c13-10-6-5-9(8-14)12(7-10)15-11-3-1-2-4-11/h5-7,11,15H,1-4H2
InChI Key:
GDINXPGWWLFMER-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1NC1CCCC1)Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.077g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.7g/mol
Monoisotopic Mass:
220.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties