2-(2-Cyclopentylhexyl)Aminoethanethiol Sulfate
[CAS# 21209-01-8]

Identification

• Name: 2-(2-Cyclopentylhexyl)Aminoethanethiol Sulfate
• Synonyms: [(2S)-2-Cyclopentylhexyl]-(2-Hydroxysulfonothioyloxyethyl)Amine; 2-((2-Cyclopentylhexyl)Amino)Ethanethiol Hydrogen Sulfate (Ester); Ethanethiol, 2-(2-Cyclopentylhexyl)Amino-, Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₃H₂₇NO₃S₂
• Molecular Weight: 309.48
• CAS Registry Number: 21209-01-8
• SMILES: [C@H](CNCCO[S](=O)(O)=S)(CCCC)C1CCCC1
• InChI: 1S/C13H27NO3S2/c1-2-3-6-13(12-7-4-5-8-12)11-14-9-10-17-19(15,16)18/h12-14H,2-11H2,1H3,(H,15,16,18)/t13-/m1/s1
• InChIKey: KBCYZECVPKKIAZ-CYBMUJFWSA-N

Properties

• Density: 1.168g/cm³ (Cal.)
• Boiling point: 435.93°C at 760 mmHg (Cal.)
• Flash point: 217.443°C (Cal.)