Home Halogens 3-Chloro-3-(4-chlorophenyl)acrylonitrile

3-Chloro-3-(4-chlorophenyl)acrylonitrile

CAS No.:
78583-86-5
Catalog Number:
AG00527Z
Molecular Formula:
C9H5Cl2N
Molecular Weight:
198.0487
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
90%
1 week
United States
$175
- +
5g
90%
1 week
United States
$450
- +
25g
90%
1 week
United States
$1275
- +
100g
90%
1 week
United States
$4198
- +
Product Description
Catalog Number:
AG00527Z
Chemical Name:
3-Chloro-3-(4-chlorophenyl)acrylonitrile
CAS Number:
78583-86-5
Molecular Formula:
C9H5Cl2N
Molecular Weight:
198.0487
MDL Number:
MFCD00052456
IUPAC Name:
(Z)-3-chloro-3-(4-chlorophenyl)prop-2-enenitrile
InChI:
InChI=1S/C9H5Cl2N/c10-8-3-1-7(2-4-8)9(11)5-6-12/h1-5H/b9-5-
InChI Key:
HAOPARUBVPVOCT-UITAMQMPSA-N
SMILES:
N#CC=C(c1ccc(cc1)Cl)Cl
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
196.98g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.046g/mol
Monoisotopic Mass:
196.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties