(6-Ethyl-4-isoquinolinyl)acetic acid
[CAS# 756809-77-5]

Identification

• Name: (6-Ethyl-4-isoquinolinyl)acetic acid
• Synonyms: 2-(6-ethylisoquinolin-4-yl)acetic acid; 4-ISOQUINOLINEACETICACID, 6-ETHYL-; 4-Isoquinolineaceticacid,6-ethyl-
• Molecular Formula: C₁₃H₁₃NO₂
• Molecular Weight: 215.25
• CAS Registry Number: 756809-77-5
• SMILES: OC(=O)Cc2cncc1ccc(cc12)CC
• InChI: 1S/C13H13NO2/c1-2-9-3-4-10-7-14-8-11(6-13(15)16)12(10)5-9/h3-5,7-8H,2,6H2,1H3,(H,15,16)
• InChIKey: FZGZWOKVPBYUCU-UHFFFAOYSA-N

Properties

• Density: 1.216g/cm³ (Cal.)
• Boiling point: 426.157°C at 760 mmHg (Cal.)
• Flash point: 211.532°C (Cal.)
• Refractive index: 1.628 (Cal.)