Home Nitriles 2-[(cyclopentylamino)methyl]benzonitrile hydrochloride

2-[(cyclopentylamino)methyl]benzonitrile hydrochloride

CAS No.:
1216412-11-1
Catalog Number:
AG01A1JO
Molecular Formula:
C13H17ClN2
Molecular Weight:
236.7405
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Product Description
Catalog Number:
AG01A1JO
Chemical Name:
2-[(cyclopentylamino)methyl]benzonitrile hydrochloride
CAS Number:
1216412-11-1
Molecular Formula:
C13H17ClN2
Molecular Weight:
236.7405
MDL Number:
MFCD22421866
IUPAC Name:
2-[(cyclopentylamino)methyl]benzonitrile;hydrochloride
InChI:
InChI=1S/C13H16N2.ClH/c14-9-11-5-1-2-6-12(11)10-15-13-7-3-4-8-13;/h1-2,5-6,13,15H,3-4,7-8,10H2;1H
InChI Key:
KTMAAEGVAMVKGJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1CNC1CCCC1.Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.108g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.743g/mol
Monoisotopic Mass:
236.108g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties