Ethyl (3E)-3-benzylidene-2-oxocyclopentanecarboxylate
[CAS# 95127-15-4]

Identification

• Name: Ethyl (3E)-3-benzylidene-2-oxocyclopentanecarboxylate
• Synonyms: 3-Benzylidene-2-oxo-cyclopentanecarboxylic acid ethyl ester
• Molecular Formula: C₁₅H₁₆O₃
• Molecular Weight: 244.29
• CAS Registry Number: 95127-15-4
• SMILES: O=C2C(=C/c1ccccc1)/CCC2C(=O)OCC
• InChI: 1S/C15H16O3/c1-2-18-15(17)13-9-8-12(14(13)16)10-11-6-4-3-5-7-11/h3-7,10,13H,2,8-9H2,1H3/b12-10+
• InChIKey: KHALZHFCWRDVCU-ZRDIBKRKSA-N

Properties

• Density: 1.179g/cm³ (Cal.)
• Boiling point: 384.032°C at 760 mmHg (Cal.)
• Flash point: 170.07°C (Cal.)