N-[2-[[(Butylthio)Carbonyl]Thio]Ethyl]Carbamothioic Acid S-Butyl Ester
[CAS# 28174-18-7]

Identification

• Name: N-[2-[[(Butylthio)Carbonyl]Thio]Ethyl]Carbamothioic Acid S-Butyl Ester
• Synonyms: 3-Methyl-4-(Sec-Butyl-(2-Sulfanylethyl)Carbamoyl)Oxy-Butanedithioic Acid; 4-[(2-Mercaptoethyl-Sec-Butylamino)-Oxomethoxy]-3-Methylbutanedithioic Acid; 4-(2-Mercaptoethyl-Sec-Butyl-Carbamoyl)Oxy-3-Methyl-Butanedithioic Acid
• Molecular Formula: C₁₂H₂₃NO₂S₃
• Molecular Weight: 309.50
• CAS Registry Number: 28174-18-7
• SMILES: C(C(S)=S)C(COC(N(CCS)C(CC)C)=O)C
• InChI: 1S/C12H23NO2S3/c1-4-10(3)13(5-6-16)12(14)15-8-9(2)7-11(17)18/h9-10,16H,4-8H2,1-3H3,(H,17,18)
• InChIKey: QMLOVGRDUWEPCW-UHFFFAOYSA-N

Properties

• Density: 1.141g/cm³ (Cal.)
• Boiling point: 406.126°C at 760 mmHg (Cal.)
• Flash point: 199.418°C (Cal.)