Butyl Hydrogen Tetrabromophthalate
[CAS# 42597-49-9]

Identification

• Name: Butyl Hydrogen Tetrabromophthalate
• Synonyms: 2,3,4,5-Tetrabromo-6-Butoxycarbonyl-Benzoic Acid; 2,3,4,5-Tetrabromo-6-(Butoxy-Oxomethyl)Benzoic Acid; Butyl Hydrogen Tetrabromophthalate
• Molecular Formula: C₁₂H₁₀Br₄O₄
• Molecular Weight: 537.82
• CAS Registry Number: 42597-49-9
• EINECS: 255-903-4
• SMILES: C(OC(C1=C(C(=C(Br)C(=C1Br)Br)Br)C(=O)O)=O)CCC
• InChI: 1S/C12H10Br4O4/c1-2-3-4-20-12(19)6-5(11(17)18)7(13)9(15)10(16)8(6)14/h2-4H2,1H3,(H,17,18)
• InChIKey: NMYAGQGGKVRMGI-UHFFFAOYSA-N

Properties

• Density: 2.116g/cm³ (Cal.)
• Boiling point: 513.656°C at 760 mmHg (Cal.)
• Flash point: 264.45°C (Cal.)