1,3-Propanediol, 2-((2-Chrysenylmethyl)Amino)-2-Methyl-, Methanesulfonate (Salt)
[CAS# 96403-59-7]

Identification

• Name: 1,3-Propanediol, 2-((2-Chrysenylmethyl)Amino)-2-Methyl-, Methanesulfonate (Salt)
• Synonyms: 2-(Chrysen-2-Ylmethylamino)-2-Methyl-Propane-1,3-Diol; Methanesulfonic Acid; 2-(2-Chrysenylmethylamino)-2-Methylpropane-1,3-Diol; Methanesulfonic Acid; 1,3-Propanediol, 2-((2-Chrysenylmethyl)Amino)-2-Methyl-, Methanesulfonate (Salt)
• Molecular Formula: C₂₄H₂₇NO₅S
• Molecular Weight: 441.54
• CAS Registry Number: 96403-59-7
• SMILES: C[S](=O)(=O)O.C2=CC1=CC(=CC=C1C3=CC=C4C(=C23)C=CC=C4)CNC(CO)(CO)C
• InChI: 1S/C23H23NO2.CH4O3S/c1-23(14-25,15-26)24-13-16-6-9-20-18(12-16)8-11-21-19-5-3-2-4-17(19)7-10-22(20)21;1-5(2,3)4/h2-12,24-26H,13-15H2,1H3;1H3,(H,2,3,4)
• InChIKey: BFQYRTBPUOQXSH-UHFFFAOYSA-N

Properties

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