O-[(2S)-2-Amino-3-Phenylpropyl] (Phenylamino)Methanethioate
[CAS# 118104-82-8]

Identification

• Name: O-[(2S)-2-Amino-3-Phenylpropyl] (Phenylamino)Methanethioate
• Synonyms: O-[(2S)-2-Amino-3-Phenyl-Propyl] (Phenylamino)Methanethioate; (Phenylamino)Methanethioic Acid O-[(2S)-2-Amino-3-Phenylpropyl] Ester; (Phenylamino)Methanethioic Acid O-[(2S)-2-Amino-3-Phenyl-Propyl] Ester
• Molecular Formula: C₁₆H₁₈N₂OS
• Molecular Weight: 286.39
• CAS Registry Number: 118104-82-8
• SMILES: [C@@H](COC(NC1=CC=CC=C1)=S)(CC2=CC=CC=C2)N
• InChI: 1S/C16H18N2OS/c17-14(11-13-7-3-1-4-8-13)12-19-16(20)18-15-9-5-2-6-10-15/h1-10,14H,11-12,17H2,(H,18,20)/t14-/m0/s1
• InChIKey: RNXJOHPVZIKWLE-AWEZNQCLSA-N

Properties

• Density: 1.221g/cm³ (Cal.)
• Boiling point: 432.346°C at 760 mmHg (Cal.)
• Flash point: 215.276°C (Cal.)