Home Nitriles 3-(4-Chlorophenyl)propionitrile

3-(4-Chlorophenyl)propionitrile

CAS No.:
32327-71-2
Catalog Number:
AG00BXSC
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$50
- +
1g
98%
In Stock USA
United States
$107
- +
5g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG00BXSC
Chemical Name:
3-(4-Chlorophenyl)propionitrile
CAS Number:
32327-71-2
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
MDL Number:
MFCD01310802
IUPAC Name:
3-(4-chlorophenyl)propanenitrile
InChI:
InChI=1S/C9H8ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,1-2H2
InChI Key:
PVNUPDOGDDNZBB-UHFFFAOYSA-N
SMILES:
N#CCCc1ccc(cc1)Cl
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.62g/mol
Monoisotopic Mass:
165.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties