2-Methyl-5-Oxocyclopent-1-En-1-Yl Phenylacetate
[CAS# 94231-44-4]

Identification

• Name: 2-Methyl-5-Oxocyclopent-1-En-1-Yl Phenylacetate
• Synonyms: 2-Phenylacetic Acid (2-Methyl-5-Oxo-1-Cyclopentenyl) Ester; 2-Phenylacetic Acid (5-Keto-2-Methyl-1-Cyclopentenyl) Ester; (2-Methyl-5-Oxo-1-Cyclopentenyl) 2-Phenylethanoate
• Molecular Formula: C₁₄H₁₄O₃
• Molecular Weight: 230.26
• CAS Registry Number: 94231-44-4
• EINECS: 303-861-3
• SMILES: C2=C(CC(OC1=C(CCC1=O)C)=O)C=CC=C2
• InChI: 1S/C14H14O3/c1-10-7-8-12(15)14(10)17-13(16)9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3
• InChIKey: NDZKPFBZWOSZAG-UHFFFAOYSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 401.77°C at 760 mmHg (Cal.)
• Flash point: 180.142°C (Cal.)