5,6-Dihydroxy-1-methyl-2,3,8,8a-tetrahydrocyclopenta[ij]isoquinolin-7(1H)-one
[CAS# 801986-71-0]

Identification

• Name: 5,6-Dihydroxy-1-methyl-2,3,8,8a-tetrahydrocyclopenta[ij]isoquinolin-7(1H)-one
• Synonyms: 5,6-dihydroxy-1-methyl-2,3,8,8a-tetrahydrocyclopenta[ij]isoquinolin-7(1H)-one
• Molecular Formula: C₁₂H₁₃NO₃
• Molecular Weight: 219.24
• CAS Registry Number: 801986-71-0
• SMILES: CN1CCc2cc(c(c3c2C1CC3=O)O)O
• InChI: 1S/C12H13NO3/c1-13-3-2-6-4-9(15)12(16)11-8(14)5-7(13)10(6)11/h4,7,15-16H,2-3,5H2,1H3
• InChIKey: QJZXVGUIICOKKV-UHFFFAOYSA-N

Properties

• Density: 1.418g/cm³ (Cal.)
• Boiling point: 430.451°C at 760 mmHg (Cal.)
• Flash point: 214.13°C (Cal.)
• Refractive index: 1.674 (Cal.)