Ethyl 8-oxo-8-[3-(1-pyrrolidinylmethyl)phenyl]octanoate
[CAS# 898771-13-6]

Identification

• Name: Ethyl 8-oxo-8-[3-(1-pyrrolidinylmethyl)phenyl]octanoate
• Synonyms: ethyl 8-oxo-8-[3-(pyrrolidinomethyl)phenyl]octanoate
• Molecular Formula: C₂₁H₃₁NO₃
• Molecular Weight: 345.48
• CAS Registry Number: 898771-13-6
• SMILES: CCOC(=O)CCCCCCC(=O)c2cc(CN1CCCC1)ccc2
• InChI: 1S/C21H31NO3/c1-2-25-21(24)13-6-4-3-5-12-20(23)19-11-9-10-18(16-19)17-22-14-7-8-15-22/h9-11,16H,2-8,12-15,17H2,1H3
• InChIKey: PMCRXLOCZBZYQX-UHFFFAOYSA-N

Properties

• Density: 1.063g/cm³ (Cal.)
• Boiling point: 464.159°C at 760 mmHg (Cal.)
• Flash point: 234.515°C (Cal.)
• Refractive index: 1.527 (Cal.)