1,2,3,4-Tetrahydro-2-Octanoylisoquinoline
[CAS# 63937-47-3]

Identification

• Name: 1,2,3,4-Tetrahydro-2-Octanoylisoquinoline
• Synonyms: Isoquinoline, 1,2,3,4-Tetrahydro-2-Octanoyl-; 1,2,3,4-Tetrahydro-2-(1-Oxooctyl)Isoquinoline; 2-Octanoyl-1,2,3,4-Tetrahydroisoquinoline
• Molecular Formula: C₁₇H₂₅NO
• Molecular Weight: 259.39
• CAS Registry Number: 63937-47-3
• SMILES: C1=CC=CC2=C1CN(CC2)C(CCCCCCC)=O
• InChI: 1S/C17H25NO/c1-2-3-4-5-6-11-17(19)18-13-12-15-9-7-8-10-16(15)14-18/h7-10H,2-6,11-14H2,1H3
• InChIKey: UGWLNAQBMGWTIZ-UHFFFAOYSA-N

Properties

• Density: 1.007g/cm³ (Cal.)
• Boiling point: 413.129°C at 760 mmHg (Cal.)
• Flash point: 168.396°C (Cal.)