Methylcarbamic Acid O-[3-(Methylthio)Propyl]Phenyl Ester
[CAS# 16637-86-8]

Identification

• Name: Methylcarbamic Acid O-[3-(Methylthio)Propyl]Phenyl Ester
• Synonyms: N-Methylcarbamic Acid [2-[3-(Methylthio)Propyl]Phenyl] Ester; 2-(3-(Methylthio)Propyl)Phenyl Methylcarbamate; Ai3-27173
• Molecular Formula: C₁₂H₁₇NO₂S
• Molecular Weight: 239.33
• CAS Registry Number: 16637-86-8
• SMILES: C1=CC=CC(=C1OC(NC)=O)CCCSC
• InChI: 1S/C12H17NO2S/c1-13-12(14)15-11-8-4-3-6-10(11)7-5-9-16-2/h3-4,6,8H,5,7,9H2,1-2H3,(H,13,14)
• InChIKey: NBUCQPQCJZGMQW-UHFFFAOYSA-N

Properties

• Density: 1.11g/cm³ (Cal.)
• Boiling point: 356.876°C at 760 mmHg (Cal.)
• Flash point: 169.633°C (Cal.)