2-(4-Cyclohexylpentyl)Aminoethanethiol Sulfate
[CAS# 21226-91-5]

Identification

• Name: 2-(4-Cyclohexylpentyl)Aminoethanethiol Sulfate
• Synonyms: [(4S)-4-Cyclohexylpentyl]-(2-Hydroxysulfonothioyloxyethyl)Amine; 2-((4-Cyclohexylpentyl)Amino)Ethanethiol Hydrogen Sulfate (Ester); Ethanethiol, 2-(4-Cyclohexylpentyl)Amino-, Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₃H₂₇NO₃S₂
• Molecular Weight: 309.48
• CAS Registry Number: 21226-91-5
• SMILES: [C@@H](CCCNCCO[S](=O)(O)=S)(C)C1CCCCC1
• InChI: 1S/C13H27NO3S2/c1-12(13-7-3-2-4-8-13)6-5-9-14-10-11-17-19(15,16)18/h12-14H,2-11H2,1H3,(H,15,16,18)/t12-/m0/s1
• InChIKey: GZOJGMCAPMVVEJ-LBPRGKRZSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 437.751°C at 760 mmHg (Cal.)
• Flash point: 218.544°C (Cal.)