Pentabromophenol

• CAS: 608-71-9
• Catalog Number: ACM608719-1
• Category: Bromine Series
• Molecular Weight: 488.59
• Molecular Formula: C6HBr5O
• Synonyms: Flammex 5BP; Pentabromophenol; Pentabromfenol;Pentabromophenol
• IUPAC Name: 2,3,4,5,6-Pentabromophenol
• Canonical SMILES: C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)O
• InChI: 1S/C6HBr5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
• InChI Key: SVHOVVJFOWGYJO-UHFFFAOYSA-N
• Boiling Point: 352.3±37.0 °C
• Melting Point: 223-226 °C
• Application: Flame Retardant
• Complexity: 150
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 487.59033
• Formal Charge: 0
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 1
• Isotope Atom Count: 0
• Monoisotopic Mass: 483.59443
• Notes: Pentabromophenol uses and applications include: Reactive flame retardant for plastics (epoxy, phenolic, rigid PU foam)
• Rotatable Bond Count: 0
• Topological Polar Surface Area: 20.2 Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0