4-Hydroxy-alpha-[[[3-(4-Methoxyphenyl)-1-Methylpropyl]Amino]Methyl]-3-(Methylsulphinyl)Benzyl Alcohol Hydrochloride
[CAS# 63251-39-8]

Identification

• Name: 4-Hydroxy-alpha-[[[3-(4-Methoxyphenyl)-1-Methylpropyl]Amino]Methyl]-3-(Methylsulphinyl)Benzyl Alcohol Hydrochloride
• Synonyms: 4-[1-Hydroxy-2-[[3-(4-Methoxyphenyl)-1-Methyl-Propyl]Amino]Ethyl]-2-Methylsulfinyl-Phenol Hydrochloride; 4-[1-Hydroxy-2-[[3-(4-Methoxyphenyl)-1-Methylpropyl]Amino]Ethyl]-2-Methylsulfinylphenol Hydrochloride; 4-[1-Hydroxy-2-[4-(4-Methoxyphenyl)Butan-2-Ylamino]Ethyl]-2-Methylsulfinyl-Phenol Hydrochloride
• Molecular Formula: C₂₀H₂₈ClNO₄S
• Molecular Weight: 413.96
• CAS Registry Number: 63251-39-8 (66264-77-5)
• EINECS: 264-046-5
• SMILES: [H+].C2=C(C(O)CNC(CCC1=CC=C(OC)C=C1)C)C=CC(=C2[S](=O)C)O.[Cl-]
• InChI: 1S/C20H27NO4S.ClH/c1-14(4-5-15-6-9-17(25-2)10-7-15)21-13-19(23)16-8-11-18(22)20(12-16)26(3)24;/h6-12,14,19,21-23H,4-5,13H2,1-3H3;1H
• InChIKey: KJSMCQZGOIBBGM-UHFFFAOYSA-N

Properties

• Boiling point: 610.1°C at 760 mmHg (Cal.)
• Flash point: 322.8°C (Cal.)