Butyl 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylate
[CAS# 36769-46-7]

Identification

• Name: Butyl 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylate
• Synonyms: 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylic Acid Butyl Ester; 1-Isoquinolinecarboxylic Acid, 1,2,3,4-Tetrahydro-4,6-Dihydroxy-2-Methyl-, Butyl; 1-Isoquinolinecarboxylic Acid, 1,2,3,4-Tetrahydro-4,6-Dihydroxy-2-Methyl-, Butyl Ester
• Molecular Formula: C₁₅H₂₁NO₄
• Molecular Weight: 279.34
• CAS Registry Number: 36769-46-7
• SMILES: C1=CC(=CC2=C1C(N(CC2O)C)C(OCCCC)=O)O
• InChI: 1S/C15H21NO4/c1-3-4-7-20-15(19)14-11-6-5-10(17)8-12(11)13(18)9-16(14)2/h5-6,8,13-14,17-18H,3-4,7,9H2,1-2H3
• InChIKey: KOCYRMKHWUYSTF-UHFFFAOYSA-N

Properties

• Density: 1.215g/cm³ (Cal.)
• Boiling point: 433.432°C at 760 mmHg (Cal.)
• Flash point: 215.932°C (Cal.)