Ethyl 5-[3-(1-azetidinylmethyl)phenyl]-5-oxopentanoate
[CAS# 898772-48-0]

Identification

• Name: Ethyl 5-[3-(1-azetidinylmethyl)phenyl]-5-oxopentanoate
• Synonyms: ethyl 5-[3-(azetidinomethyl)phenyl]-5-oxovalerate
• Molecular Formula: C₁₇H₂₃NO₃
• Molecular Weight: 289.37
• CAS Registry Number: 898772-48-0
• SMILES: CCOC(=O)CCCC(=O)c1cccc(c1)CN2CCC2
• InChI: 1S/C17H23NO3/c1-2-21-17(20)9-4-8-16(19)15-7-3-6-14(12-15)13-18-10-5-11-18/h3,6-7,12H,2,4-5,8-11,13H2,1H3
• InChIKey: KNBFVVRERFMAKY-UHFFFAOYSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 422.999°C at 760 mmHg (Cal.)
• Flash point: 209.623°C (Cal.)
• Refractive index: 1.545 (Cal.)