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59080-40-9

59080-40-9 structural image
Product Name: 2,2',4,4',5,5'-HEXABROMOBIPHENYL
Formula: C12H4Br6
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Polybrominated biphenyl appears as a white chalky solid. Softens at 162 °F. (NTP, 1992)
Color/Form White solid
Boiling Point 72 °C
Melting Point 246 to 250 °F (NTP, 1992)
Solubility less than 1 mg/mL at 64 °F (NTP, 1992)
Vapor Pressure 7.6e-05 mmHg at 194 °F (NTP, 1992)
LogP log Kow = 6.39
Henry's Law Constant Henry's Law constant = 4.3X10-6 atm-cu m/mole at 25 °C
Stability/Shelf Life Degrades readily in UV light.
Kovats Retention Index 2819.8
Chemical Classes Plastics & Rubber -> Other Plasticizers

COMPUTED DESCRIPTORS

Molecular Weight 627.6 g/mol
XLogP3 7.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 1
Exact Mass 627.53518 g/mol
Monoisotopic Mass 621.54133 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 258
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Polybrominated biphenyl appears as a white chalky solid. Softens at 162 °F. (NTP, 1992)