Home Nitriles 1-Phenylcyclohexanecarbonitrile

1-Phenylcyclohexanecarbonitrile

CAS No.:
2201-23-2
Catalog Number:
AG00BCDE
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$50
- +
5g
96%
In Stock USA
United States
$125
- +
25g
96%
In Stock USA
United States
$400
- +
100g
96%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00BCDE
Chemical Name:
1-Phenylcyclohexanecarbonitrile
CAS Number:
2201-23-2
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
MDL Number:
MFCD00021281
IUPAC Name:
1-phenylcyclohexane-1-carbonitrile
InChI:
InChI=1S/C13H15N/c14-11-13(9-5-2-6-10-13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2
InChI Key:
AUXIEQKHXAYAHG-UHFFFAOYSA-N
SMILES:
N#CC1(CCCCC1)c1ccccc1
EC Number:
218-608-1
NSC Number:
106872
Properties
Complexity:
223  
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:
3.5  
Properties