Home Nitriles 2-(2-Chloro-phenyl)-propionitrile

2-(2-Chloro-phenyl)-propionitrile

CAS No.:
75920-46-6
Catalog Number:
AG00596Q
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$177
- +
1g
97%
1 week
United States
$385
- +
5g
97%
1 week
United States
$1080
- +
Product Description
Catalog Number:
AG00596Q
Chemical Name:
2-(2-Chloro-phenyl)-propionitrile
CAS Number:
75920-46-6
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
MDL Number:
MFCD10687167
IUPAC Name:
2-(2-chlorophenyl)propanenitrile
InChI:
InChI=1S/C9H8ClN/c1-7(6-11)8-4-2-3-5-9(8)10/h2-5,7H,1H3
InChI Key:
XOMXWBCHMZFRQX-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccc1Cl)C
Properties
Complexity:
170  
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:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties