2-Methyl-2-Propanyl 3-Formyl-3,4-Dihydro-2(1H)-Isoquinolinecarboxylate
[CAS# 104668-15-7]

Identification

• Name: 2-Methyl-2-Propanyl 3-Formyl-3,4-Dihydro-2(1H)-Isoquinolinecarboxylate
• Synonyms: 2(1H)-ISOQUINOLINECARBOXYLIC ACID, 3-FORMYL-3,4-DIHYDRO-,1,1-DIMETHYLETHYL ESTER, (3R)-; 3-Formyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester; 3-Formyl-3,4-dihydro-1H-isoquinoline-2-carboxylicacidtert-butylester
• Molecular Formula: C₁₅H₁₉NO₃
• Molecular Weight: 261.32
• CAS Registry Number: 104668-15-7
• SMILES: CC(C)(C)OC(=O)N1Cc2ccccc2CC1C=O
• InChI: 1S/C15H19NO3/c1-15(2,3)19-14(18)16-9-12-7-5-4-6-11(12)8-13(16)10-17/h4-7,10,13H,8-9H2,1-3H3
• InChIKey: RQBSVZLMTABKNG-UHFFFAOYSA-N

Properties

• Density: 1.182g/cm³ (Cal.)
• Boiling point: 382.238°C at 760 mmHg (Cal.)
• Flash point: 184.971°C (Cal.)
• Refractive index: 1.578 (Cal.)