Home Nitriles 2-[4-(cyclohexylamino)phenyl]acetonitrile

2-[4-(cyclohexylamino)phenyl]acetonitrile

CAS No.:
1157685-94-3
Catalog Number:
AG01A898
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
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Product Description
Catalog Number:
AG01A898
Chemical Name:
2-[4-(cyclohexylamino)phenyl]acetonitrile
CAS Number:
1157685-94-3
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
MDL Number:
MFCD12038984
IUPAC Name:
2-[4-(cyclohexylamino)phenyl]acetonitrile
InChI:
InChI=1S/C14H18N2/c15-11-10-12-6-8-14(9-7-12)16-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10H2
InChI Key:
GTEHIRQTNHTJRU-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(cc1)NC1CCCCC1
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.147g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.312g/mol
Monoisotopic Mass:
214.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties