Ethyl 8-(benzyloxy)-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
[CAS# 629662-41-5]

Identification

• Name: Ethyl 8-(benzyloxy)-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
• Synonyms: Azepino[4,5-b]indole-5-carboxylic acid, 1,2,3,6-tetrahydro-1,1-dimethyl-8-(phenylmethoxy)-, ethyl ester; Azepino[4,5-b]indole-5-carboxylic acid,1,2,3,6-tetrahydro-1,1-dimethyl-8-(phenylmethoxy)-,ethyl ester
• Molecular Formula: C₂₄H₂₆N₂O₃
• Molecular Weight: 390.47
• CAS Registry Number: 629662-41-5
• SMILES: CCOC(=O)C1=CNCC(c2c1[nH]c3c2ccc(c3)OCc4ccccc4)(C)C
• InChI: 1S/C24H26N2O3/c1-4-28-23(27)19-13-25-15-24(2,3)21-18-11-10-17(12-20(18)26-22(19)21)29-14-16-8-6-5-7-9-16/h5-13,25-26H,4,14-15H2,1-3H3
• InChIKey: QXIBLGIBKFQSDW-UHFFFAOYSA-N

Properties

• Density: 1.18g/cm³ (Cal.)
• Boiling point: 603.615°C at 760 mmHg (Cal.)
• Flash point: 318.855°C (Cal.)
• Refractive index: 1.607 (Cal.)