3,4,5,6-Tetrabromo-1,2-Benzenedicarboxylicacid
[CAS 13810-83-8]

Identification

• Name: 3,4,5,6-Tetrabromo-1,2-Benzenedicarboxylicacid
• Synonyms: 1,2-Benzenedicarboxylic Acid, 3,4,5,6-Tetrabromo-, Aluminum Salt (3:2); Aluminium Tetrabromophthalate (3:2); Aluminum Tetrabromophthalate
• Molecular Formula: C₂₄Al₂Br₁₂O₁₂
• Molecular Weight: 1493.07
• CAS Registry Number: 13810-83-8
• SMILES: BrC1=C(Br)C(=C(Br)C(=C1C([O-])=O)C([O-])=O)Br.[Al+3].[Al+3].C2(=C(C(=C(Br)C(=C2Br)Br)Br)C([O-])=O)C([O-])=O.C3(=C(C(=C(Br)C(=C3Br)Br)Br)C([O-])=O)C([O-])=O
• InChI: 1S/3C8H2Br4O4.2Al/c3*9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;;/h3*(H,13,14)(H,15,16);;/q;;;2*+3/p-6
• InChIKey: IEDRHGTVBAATJV-UHFFFAOYSA-H

Properties

• Boiling point: 494.3°C at 760 mmHg (Cal.)
• Flash point: 252.8°C (Cal.)