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113468-54-5 | Benzene, 1-chloro-2-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]-
CAS No: 113468-54-5 Catalog No: AG0008OW MDL No:
Product Description
Catalog Number:
AG0008OW
Chemical Name:
Benzene, 1-chloro-2-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]-
CAS Number:
113468-54-5
Molecular Formula:
C14H8Cl6
Molecular Weight:
388.9313
IUPAC Name:
1-chloro-2-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]benzene
InChI:
InChI=1S/C14H8Cl6/c15-10-7-5-9(6-8-10)13(17,14(18,19)20)11-3-1-2-4-12(11)16/h1-8H
InChI Key:
OKLCLELNELHMEB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(C(Cl)(Cl)Cl)(c1ccccc1Cl)Cl
NSC Number:
117337
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.873g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.918g/mol
Monoisotopic Mass:
385.876g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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