3-[(6-Methyl-5H-Pyrido[3',4':4,5]Pyrrolo[2,3-g]Isoquinolin-10-Yl)Amino]-1,2-Propanediol
[CAS# 83948-01-0]

Identification

• Name: 3-[(6-Methyl-5H-Pyrido[3',4':4,5]Pyrrolo[2,3-g]Isoquinolin-10-Yl)Amino]-1,2-Propanediol
• Synonyms: 3-((6-Methyl-5H-Pyrido(3',4':4,5)Pyrrolo(2,3-G)Isoquinolin-10-Yl)Amino)-1,2-Propanediol; 5H-Pyrido(3',4':4,5)Pyrrolo(2,3-G)Isoquinoline, 1,2-Propanediol Deriv.; Brn 5612652
• Molecular Formula: C₁₈H₁₈N₄O₂
• Molecular Weight: 322.37
• CAS Registry Number: 83948-01-0
• SMILES: C1=NC(=C2C(=C1)C(=C4C(=C2)C3=CN=CC=C3[NH]4)C)NCC(CO)O
• InChI: 1S/C18H18N4O2/c1-10-12-2-5-20-18(21-7-11(24)9-23)14(12)6-13-15-8-19-4-3-16(15)22-17(10)13/h2-6,8,11,22-24H,7,9H2,1H3,(H,20,21)
• InChIKey: HUVKYAHKSFDBDI-UHFFFAOYSA-N

Properties

• Density: 1.461g/cm³ (Cal.)
• Boiling point: 736.972°C at 760 mmHg (Cal.)
• Flash point: 399.506°C (Cal.)