2-[4-(2-Methoxycyclohexyl)Butyl]Aminoethanethiol Sulfate
[CAS# 19142-95-1]

Identification

• Name: 2-[4-(2-Methoxycyclohexyl)Butyl]Aminoethanethiol Sulfate
• Synonyms: 2-Hydroxysulfonothioyloxyethyl-[4-[(2S)-2-Methoxycyclohexyl]Butyl]Amine; Thiosulfuric Acid, S-(2-((4-(2-Methoxycyclohexyl)Butyl)Amino)Ethyl) Ester; 2-((4-(2-Methoxycyclohexyl)Butyl)Amino)Ethanethiol Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₃H₂₇NO₄S₂
• Molecular Weight: 325.48
• CAS Registry Number: 19142-95-1
• SMILES: [C@@H]1(OC)C(CCCC1)CCCCNCCO[S](=S)(=O)O
• InChI: 1S/C13H27NO4S2/c1-17-13-8-3-2-6-12(13)7-4-5-9-14-10-11-18-20(15,16)19/h12-14H,2-11H2,1H3,(H,15,16,19)/t12?,13-/m0/s1
• InChIKey: MMISKLSMCQTQDN-ABLWVSNPSA-N

Properties

• Density: 1.201g/cm³ (Cal.)
• Boiling point: 452.904°C at 760 mmHg (Cal.)
• Flash point: 227.708°C (Cal.)