Ethyl (3-cyanophenyl)(oxo)acetate
[CAS# 732249-89-7]

Identification

• Name: Ethyl (3-cyanophenyl)(oxo)acetate
• Synonyms: Ethyl 2-(3-cyanophenyl)-2-oxoacetate; Ethyl 3-cyanobenzoylformate; MFCD01319613
• Molecular Formula: C₁₁H₉NO₃
• Molecular Weight: 203.19
• CAS Registry Number: 732249-89-7
• SMILES: N#Cc1cccc(c1)C(=O)C(=O)OCC
• InChI: 1S/C11H9NO3/c1-2-15-11(14)10(13)9-5-3-4-8(6-9)7-12/h3-6H,2H2,1H3
• InChIKey: GECHQYJYTIZQSB-UHFFFAOYSA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 333.955°C at 760 mmHg (Cal.)
• Flash point: 145.55°C (Cal.)
• Refractive index: 1.536 (Cal.)

Safety Data

• Safety Description: REFRIGERATE, FLAMMABLE