Home Halogens 1,2-dichloro-3-(2-nitroethenyl)benzene

1,2-dichloro-3-(2-nitroethenyl)benzene

CAS No.:
154455-57-9
Catalog Number:
AG01BH0T
Molecular Formula:
C8H5Cl2NO2
Molecular Weight:
218.0368
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Product Description
Catalog Number:
AG01BH0T
Chemical Name:
1,2-dichloro-3-(2-nitroethenyl)benzene
CAS Number:
154455-57-9
Molecular Formula:
C8H5Cl2NO2
Molecular Weight:
218.0368
MDL Number:
MFCD00297075
IUPAC Name:
1,2-dichloro-3-(2-nitroethenyl)benzene
InChI:
InChI=1S/C8H5Cl2NO2/c9-7-3-1-2-6(8(7)10)4-5-11(12)13/h1-5H
InChI Key:
QDRLNSJTMBNERI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C=Cc1cccc(c1Cl)Cl
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.97g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.033g/mol
Monoisotopic Mass:
216.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.5  
Properties