CAS
52663-65-7 Purity
96%
52663-65-7 Purity
96%
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2,2',3,4,4',5',6-Heptachlorobiphenyl
CAS
52663-69-1
Catalog Number
ACM52663691
Category
Other Products
Molecular Weight
395.3
Molecular Formula
C12H3Cl7
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Specification
Synonyms
1,1'-Biphenyl, 2,2',3,4,4',5',6-heptachloro-
IUPAC Name
1,2,3,5-tetrachloro-4-(2,4,5-trichlorophenyl)benzene
Canonical SMILES
C1=C(C(=CC(=C1Cl)Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl
InChI Key
KQBFUDNJKCZEDQ-UHFFFAOYSA-N
Boiling Point
407.2ºC at 760mmHg
Flash Point
198.2ºC
Density
1.658g/cm³
Complexity
313
Defined Atom Stereocenter Count
0
Exact Mass
393.8024
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
19
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
393.8024
Rotatable Bond Count
1
Topological Polar Surface Area
0 Ų
XLogP3-AA
7.4
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