Ethyl [(1S)-8-ethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl]acetate
[CAS# 87249-11-4]

Identification

• Name: Ethyl [(1S)-8-ethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl]acetate
• Synonyms: (+)-Etodolic acid; BRN 5761988; RAK-592
• Molecular Formula: C₁₇H₂₁NO₃
• Molecular Weight: 287.35
• CAS Registry Number: 87249-11-4
• SMILES: O=C(OCC)C[C@@H]3OCCc2c3nc1c(cccc12)CC
• InChI: 1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-14(10-15(19)20-4-2)17(13)18-16(11)12/h5-7,14,18H,3-4,8-10H2,1-2H3/t14-/m0/s1
• InChIKey: LWEXZSRSAUWKGZ-AWEZNQCLSA-N

Properties

• Density: 1.165g/cm³ (Cal.)
• Boiling point: 452.585°C at 760 mmHg (Cal.)
• Flash point: 227.515°C (Cal.)