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88218-49-9 | Benzene, 1,4-dichloro-2-(trichloroethenyl)-
CAS No: 88218-49-9 Catalog No: AG004BBA MDL No:
Product Description
Catalog Number:
AG004BBA
Chemical Name:
Benzene, 1,4-dichloro-2-(trichloroethenyl)-
CAS Number:
88218-49-9
Molecular Formula:
C8H3Cl5
Molecular Weight:
276.3744
IUPAC Name:
1,4-dichloro-2-(1,2,2-trichloroethenyl)benzene
InChI:
InChI=1S/C8H3Cl5/c9-4-1-2-6(10)5(3-4)7(11)8(12)13/h1-3H
InChI Key:
DYIXZBHLSJWHAI-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=C(Cl)Cl)Cl)Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.865g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.362g/mol
Monoisotopic Mass:
273.868g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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