[(2S,3Z)-2-Hydroxy-3-(5-Oxofuran-2-Ylidene)Propyl] Benzoate
[CAS# 135626-19-6]

Identification

• Name: [(2S,3Z)-2-Hydroxy-3-(5-Oxofuran-2-Ylidene)Propyl] Benzoate
• Synonyms: [(2S,3Z)-2-Hydroxy-3-(5-Oxo-2-Furylidene)Propyl] Benzoate; Benzoic Acid [(2S,3Z)-2-Hydroxy-3-(5-Oxo-2-Furylidene)Propyl] Ester; Benzoic Acid [(2S,3Z)-2-Hydroxy-3-(5-Keto-2-Furylidene)Propyl] Ester
• Molecular Formula: C₁₄H₁₂O₅
• Molecular Weight: 260.25
• CAS Registry Number: 135626-19-6
• SMILES: [C@H](O)(\C=C1/OC(=O)C=C1)COC(=O)C2=CC=CC=C2
• InChI: 1S/C14H12O5/c15-11(8-12-6-7-13(16)19-12)9-18-14(17)10-4-2-1-3-5-10/h1-8,11,15H,9H2/b12-8-/t11-/m0/s1
• InChIKey: WQHRXHYOKDRIRR-LCFDYFRESA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 503.788°C at 760 mmHg (Cal.)
• Flash point: 195.572°C (Cal.)