3-Bromo-2-Oxopentanedioic Acid
[CAS# 76444-16-1]

Identification

• Name: 3-Bromo-2-Oxopentanedioic Acid
• Synonyms: 3-Bromo-2-Oxo-Pentanedioic Acid; 3-Bromo-2-Keto-Glutaric Acid; 3-Bromo-2-Ketoglutarate
• Molecular Formula: C₅H₅BrO₅
• Molecular Weight: 225.00
• CAS Registry Number: 76444-16-1
• SMILES: C(C(Br)C(=O)C(=O)O)C(=O)O
• InChI: 1S/C5H5BrO5/c6-2(1-3(7)8)4(9)5(10)11/h2H,1H2,(H,7,8)(H,10,11)
• InChIKey: QFGLEMGINFKMPT-UHFFFAOYSA-N

Properties

• Density: 2.027g/cm³ (Cal.)
• Boiling point: 347.068°C at 760 mmHg (Cal.)
• Flash point: 163.701°C (Cal.)