Home Nitriles 4-phenylcyclohexane-1-carbonitrile

4-phenylcyclohexane-1-carbonitrile

CAS No.:
32274-07-0
Catalog Number:
AG01AN5S
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
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Product Description
Catalog Number:
AG01AN5S
Chemical Name:
4-phenylcyclohexane-1-carbonitrile
CAS Number:
32274-07-0
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
MDL Number:
MFCD11537301
IUPAC Name:
4-phenylcyclohexane-1-carbonitrile
InChI:
InChI=1S/C13H15N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-5,11,13H,6-9H2
InChI Key:
ZBTVTAHVQRAIMW-UHFFFAOYSA-N
SMILES:
N#CC1CCC(CC1)c1ccccc1
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.12g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.27g/mol
Monoisotopic Mass:
185.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties