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

• CAS: 52712-05-7
• Catalog Number: ACM52712057
• Category: Other Products
• Molecular Weight: 395.3
• Molecular Formula: C12H3Cl7
• Synonyms: 1,2,3,4,5-pentachloro-6-(2,5-dichlorophenyl)benzene
• IUPAC Name: 1,2,3,4,5-pentachloro-6-(2,5-dichlorophenyl)benzene
• Canonical SMILES: C1=CC(=C(C=C1Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl
• InChI Key: PYZHTHZEHQHHEN-UHFFFAOYSA-N
• Boiling Point: 408.3ºC at 760 mmHg
• Flash Point: 199ºC
• Density: 1.658 g/cm³
• Complexity: 297
• Defined Atom Stereocenter Count: 0
• Exact Mass: 393.80249
• 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: 393.80249
• Rotatable Bond Count: 1
• Topological Polar Surface Area: 0 Ų
• XLogP3-AA: 7.5