(1R,2S,5S)-2-Methyl-4-Oxo-3-Oxabicyclo[3.1.0]Hexane-5-Carboxylic Acid
[CAS# 161870-17-3]

Identification

• Name: (1R,2S,5S)-2-Methyl-4-Oxo-3-Oxabicyclo[3.1.0]Hexane-5-Carboxylic Acid
• Synonyms: (1S,4S,5R)-4-methyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylic acid
• Molecular Formula: C₇H₈O₄
• Molecular Weight: 156.14
• CAS Registry Number: 161870-17-3
• SMILES: O=C(O)[C@]21C(=O)O[C@@H](C)[C@@H]1C2
• InChI: 1S/C7H8O4/c1-3-4-2-7(4,5(8)9)6(10)11-3/h3-4H,2H2,1H3,(H,8,9)/t3-,4-,7-/m0/s1
• InChIKey: WFROVNZRTXRFTP-FVSJBQLASA-N

Properties

• Density: 1.531g/cm³ (Cal.)
• Boiling point: 385.434°C at 760 mmHg (Cal.)
• Flash point: 169.796°C (Cal.)
• Refractive index: 1.572 (Cal.)