2-((Benzo(c)phenanthren-5-ylmethyl)amino)-2-methyl-1,3-propanediol methanesulfonate
[CAS# 104500-15-4]

Identification

• Name: 2-((Benzo(c)phenanthren-5-ylmethyl)amino)-2-methyl-1,3-propanediol methanesulfonate
• Synonyms: 2-(Benzo[C]Phenanthren-8-Ylmethylamino)-2-Methyl-Propane-1,3-Diol; Methanesulfonic Acid; 2-(8-Benzo[C]Phenanthrenylmethylamino)-2-Methylpropane-1,3-Diol; Methanesulfonic Acid; 2-((Benzo(C)Phenanthren-5-Ylmethyl)Amino)-2-Methyl-1,3-Propanediol Methanesulfonate (Salt)
• Molecular Formula: C₂₄H₂₇NO₅S
• Molecular Weight: 441.54
• CAS Registry Number: 104500-15-4
• SMILES: C[S](=O)(=O)O.C1=C(C4=C(C2=C3C(=CC=C12)C=CC=C3)C=CC=C4)CNC(CO)(CO)C
• InChI: 1S/C23H23NO2.CH4O3S/c1-23(14-25,15-26)24-13-18-12-17-11-10-16-6-2-3-8-20(16)22(17)21-9-5-4-7-19(18)21;1-5(2,3)4/h2-12,24-26H,13-15H2,1H3;1H3,(H,2,3,4)
• InChIKey: ASUDSDBJVJGMPB-UHFFFAOYSA-N

Properties

• Boiling point: 620.9°C at 760 mmHg (Cal.)
• Flash point: 194.5°C (Cal.)