3-(5,5-Dimethyl-5,6-Dihydro[1,2,4]Triazolo[3,4-a]Isoquinolin-3-Yl)Phenol
[CAS# 330998-71-5]

Identification

• Name: 3-(5,5-Dimethyl-5,6-Dihydro[1,2,4]Triazolo[3,4-a]Isoquinolin-3-Yl)Phenol
• Synonyms: 3-(6,6-dimethyl-5,6,7-trihydro-1,2,4-triazolo[3,4-a]isoquinolin-8-yl)phenol; MFCD00608468; BAS 00329335
• Molecular Formula: C₁₈H₁₇N₃O
• Molecular Weight: 291.35
• CAS Registry Number: 330998-71-5
• SMILES: CC1(CC2=CC=CC=C2C3=NN=C(N31)C4=CC(=CC=C4)O)C
• InChI: 1S/C18H17N3O/c1-18(2)11-13-6-3-4-9-15(13)17-20-19-16(21(17)18)12-7-5-8-14(22)10-12/h3-10,22H,11H2,1-2H3
• InChIKey: OUNBBIYHRZELDA-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 533.3±60.0°C at 760 mmHg (Cal.)
• Flash point: 276.3±32.9°C (Cal.)
• Refractive index: 1.677 (Cal.)