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Structure

2,3',4,5',6-Pentachlorobiphenyl

CAS
56558-18-0
Catalog Number
ACM56558180
Category
Other Products
Molecular Weight
326.4
Molecular Formula
C12H5Cl5

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Specification

Synonyms
1,1'-Biphenyl, 2,3',4,5',6-pentachloro-
IUPAC Name
1,3,5-trichloro-2-(3,5-dichlorophenyl)benzene
Canonical SMILES
C1=C(C=C(C=C1Cl)Cl)C2=C(C=C(C=C2Cl)Cl)Cl
InChI Key
XBVSGJGMWSKAKL-UHFFFAOYSA-N
Boiling Point
372.9ºCat 760 mmHg
Flash Point
179.2ºC
Density
1.522 g/cm³
Complexity
237
Defined Atom Stereocenter Count
0
Exact Mass
325.8804
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
17
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
325.8804
Rotatable Bond Count
1
Topological Polar Surface Area
0 Ų
XLogP3-AA
6.5
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