[[[Methyl(Phenylmethyl)Amino]Thioxomethyl]Thio]Acetic Acid Methyl Ester
[CAS# 64057-87-0]

Identification

• Name: [[[Methyl(Phenylmethyl)Amino]Thioxomethyl]Thio]Acetic Acid Methyl Ester
• Synonyms: 2-[[(Methyl-(Phenylmethyl)Amino)-Thioxomethyl]Thio]Acetic Acid Methyl Ester; 2-[(Benzyl-Methyl-Thiocarbamoyl)Thio]Acetic Acid Methyl Ester; Methyl 2-(Methyl-(Phenylmethyl)Carbamothioyl)Sulfanylethanoate
• Molecular Formula: C₁₂H₁₅NO₂S₂
• Molecular Weight: 269.38
• CAS Registry Number: 64057-87-0
• SMILES: C1=CC=CC=C1CN(C(SCC(OC)=O)=S)C
• InChI: 1S/C12H15NO2S2/c1-13(8-10-6-4-3-5-7-10)12(16)17-9-11(14)15-2/h3-7H,8-9H2,1-2H3
• InChIKey: WALPFCHWMYDJPG-UHFFFAOYSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 373.135°C at 760 mmHg (Cal.)
• Flash point: 179.466°C (Cal.)