Ethyl 7-[3-(2,5-dihydro-1H-pyrrol-1-ylmethyl)phenyl]-7-oxoheptanoate
[CAS# 898749-82-1]

Identification

• Name: Ethyl 7-[3-(2,5-dihydro-1H-pyrrol-1-ylmethyl)phenyl]-7-oxoheptanoate
• Synonyms: Ethyl 7-oxo-7-[3-(3-pyrrolinomethyl)phenyl]heptanoate
• Molecular Formula: C₂₀H₂₇NO₃
• Molecular Weight: 329.43
• CAS Registry Number: 898749-82-1
• SMILES: CCOC(=O)CCCCCC(=O)c2cc(CN1C\C=C/C1)ccc2
• InChI: 1S/C20H27NO3/c1-2-24-20(23)12-5-3-4-11-19(22)18-10-8-9-17(15-18)16-21-13-6-7-14-21/h6-10,15H,2-5,11-14,16H2,1H3
• InChIKey: FKTYJRUTJNVVTD-UHFFFAOYSA-N

Properties

• Density: 1.091g/cm³ (Cal.)
• Boiling point: 457.411°C at 760 mmHg (Cal.)
• Flash point: 230.434°C (Cal.)
• Refractive index: 1.541 (Cal.)