Home Other Building Blocks 2-(2-Cyanethyl)cyclohexanone

2-(2-Cyanethyl)cyclohexanone

CAS No.:
4594-78-9
Catalog Number:
AG003EZI
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$19
- +
5g
97%
In Stock USA
United States
$57
- +
25g
97%
In Stock USA
United States
$125
- +
100g
97%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG003EZI
Chemical Name:
2-(2-Cyanethyl)cyclohexanone
CAS Number:
4594-78-9
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
MDL Number:
MFCD00013797
IUPAC Name:
3-(2-oxocyclohexyl)propanenitrile
InChI:
InChI=1S/C9H13NO/c10-7-3-5-8-4-1-2-6-9(8)11/h8H,1-6H2
InChI Key:
SPTVCXKSSRBTMN-UHFFFAOYSA-N
SMILES:
N#CCCC1CCCCC1=O
EC Number:
224-991-6
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties