(4S,5S)-4-Acetoxy-5-Hydroxy-5-Hydroxymethyl-2-Cyclopenten-1-One
[CAS# 50655-21-5]

Identification

• Name: (4S,5S)-4-Acetoxy-5-Hydroxy-5-Hydroxymethyl-2-Cyclopenten-1-One
• Synonyms: Acetic Acid [(1S,5S)-5-Hydroxy-5-(Hydroxymethyl)-4-Oxo-1-Cyclopent-2-Enyl] Ester; Acetic Acid [(1S,5S)-5-Hydroxy-4-Keto-5-Methylol-1-Cyclopent-2-Enyl] Ester; [(1S,5S)-5-Hydroxy-5-(Hydroxymethyl)-4-Oxo-1-Cyclopent-2-Enyl] Ethanoate
• Molecular Formula: C₈H₁₀O₅
• Molecular Weight: 186.16
• CAS Registry Number: 50655-21-5
• SMILES: [C@@H]1(C=CC([C@@]1(CO)O)=O)OC(=O)C
• InChI: 1S/C8H10O5/c1-5(10)13-7-3-2-6(11)8(7,12)4-9/h2-3,7,9,12H,4H2,1H3/t7-,8+/m0/s1
• InChIKey: AGNRGFRAFJOXHH-JGVFFNPUSA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 339.774°C at 760 mmHg (Cal.)
• Flash point: 139.725°C (Cal.)