2-(1-Dimethylamino-3-Methylbutan-2-Yl)-5-Heptylsulfanylbenzene-1,4-Diol Hydroiodide
[CAS# 129658-39-5]

Identification

• Name: 2-(1-Dimethylamino-3-Methylbutan-2-Yl)-5-Heptylsulfanylbenzene-1,4-Diol Hydroiodide
• Synonyms: 2-[1-(Dimethylaminomethyl)-2-Methyl-Propyl]-5-Heptylsulfanyl-Benzene-1,4-Diol Hydroiodide; 2-[1-(Dimethylaminomethyl)-2-Methylpropyl]-5-(Heptylthio)Benzene-1,4-Diol Hydroiodide; 2-[1-(Dimethylaminomethyl)-2-Methyl-Propyl]-5-(Heptylthio)Hydroquinone Hydroiodide
• Molecular Formula: C₂₀H₃₆INO₂S
• Molecular Weight: 481.47
• CAS Registry Number: 129658-39-5
• SMILES: [H+].C1=C(C(C(C)C)CN(C)C)C(=CC(=C1O)SCCCCCCC)O.[I-]
• InChI: 1S/C20H35NO2S.HI/c1-6-7-8-9-10-11-24-20-13-18(22)16(12-19(20)23)17(15(2)3)14-21(4)5;/h12-13,15,17,22-23H,6-11,14H2,1-5H3;1H
• InChIKey: OZXRTISPEXIWEP-UHFFFAOYSA-N

Properties

• Boiling point: 477.5°C at 760 mmHg (Cal.)
• Flash point: 242.6°C (Cal.)