2,2',4,5,5'-Pentachlorobiphenyl

• CAS: 37680-73-2
• Catalog Number: ACM37680732
• Category: Other Products
• Molecular Weight: 326.4
• Molecular Formula: C12H5Cl5
• Synonyms: 1,1'-Biphenyl, 2,2',4,5,5'-pentachloro-
• IUPAC Name: 1,2,4-trichloro-5-(2,5-dichlorophenyl)benzene
• Canonical SMILES: C1=CC(=C(C=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl
• InChI Key: LAHWLEDBADHJGA-UHFFFAOYSA-N
• Boiling Point: 371ºC at 760 mmHg
• Flash Point: 177.8ºC
• Density: 1.522 g/cm³
• Complexity: 259
• Defined Atom Stereocenter Count: 0
• Exact Mass: 325.8804
• Formal Charge: 0
• Hazard Statements: N,Xn,F
• 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
• Packing Group: II
• Rotatable Bond Count: 1
• Safety Description: S35
• Topological Polar Surface Area: 0 Ų
• XLogP3-AA: 6.5