Crisnatol
[CAS# 96389-68-3]

Identification

• Name: Crisnatol
• Synonyms: 2-(Chrysen-6-Ylmethylamino)-2-Methyl-Propane-1,3-Diol; 2-(6-Chrysenylmethylamino)-2-Methylpropane-1,3-Diol; 1,3-Propanediol, 2-((6-Chrysenylmethyl)Amino)-2-Methyl-
• Molecular Formula: C₂₃H₂₃NO₂
• Molecular Weight: 345.44
• CAS Registry Number: 96389-68-3
• SMILES: C1=C3C(=C2C(=C1CNC(CO)(CO)C)C=CC=C2)C=CC4=CC=CC=C34
• InChI: 1S/C23H23NO2/c1-23(14-25,15-26)24-13-17-12-22-18-7-3-2-6-16(18)10-11-21(22)20-9-5-4-8-19(17)20/h2-12,24-26H,13-15H2,1H3
• InChIKey: SBRXTSOCZITGQG-UHFFFAOYSA-N

Properties

• Density: 1.243g/cm³ (Cal.)
• Boiling point: 620.931°C at 760 mmHg (Cal.)
• Flash point: 194.502°C (Cal.)