2-Benzoyl-1,2,3,4-Tetrahydro-3-Isoquinolinecarboxylic Acid
[CAS# 115732-15-5]

Identification

• Name: 2-Benzoyl-1,2,3,4-Tetrahydro-3-Isoquinolinecarboxylic Acid
• Synonyms: 2-(phenylcarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid; 2-Benzoyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
• Molecular Formula: C₁₇H₁₅NO₃
• Molecular Weight: 281.31
• CAS Registry Number: 115732-15-5
• SMILES: C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3)C(=O)O
• InChI: 1S/C17H15NO3/c19-16(12-6-2-1-3-7-12)18-11-14-9-5-4-8-13(14)10-15(18)17(20)21/h1-9,15H,10-11H2,(H,20,21)
• InChIKey: QBBPKILWLZTVIC-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 520.0±50.0°C at 760 mmHg (Cal.)
• Flash point: 268.3±30.1°C (Cal.)
• Refractive index: 1.637 (Cal.)

Safety Data

• Safety Description: IRRITANT