S-[2-[(2S)-2-[(2-Methoxyphenoxy)Methyl]Pyrrolidin-1-Yl]-2-Oxoethyl] Ethanethioate
[CAS# 161364-88-1]

Identification

• Name: S-[2-[(2S)-2-[(2-Methoxyphenoxy)Methyl]Pyrrolidin-1-Yl]-2-Oxoethyl] Ethanethioate
• Synonyms: S-[2-[(2S)-2-[(2-Methoxyphenoxy)Methyl]Pyrrolidin-1-Yl]-2-Oxo-Ethyl] Ethanethioate; Ethanethioic Acid S-[2-[(2S)-2-[(2-Methoxyphenoxy)Methyl]-1-Pyrrolidinyl]-2-Oxoethyl] Ester; Ethanethioic Acid S-[2-Keto-2-[(2S)-2-[(2-Methoxyphenoxy)Methyl]Pyrrolidin-1-Yl]Ethyl] Ester
• Molecular Formula: C₁₆H₂₁NO₄S
• Molecular Weight: 323.41
• CAS Registry Number: 161364-88-1
• SMILES: [C@@H]1(N(C(=O)CSC(=O)C)CCC1)COC2=CC=CC=C2OC
• InChI: 1S/C16H21NO4S/c1-12(18)22-11-16(19)17-9-5-6-13(17)10-21-15-8-4-3-7-14(15)20-2/h3-4,7-8,13H,5-6,9-11H2,1-2H3/t13-/m0/s1
• InChIKey: ARYIGUABCXSPSO-ZDUSSCGKSA-N

Properties

• Density: 1.204g/cm³ (Cal.)
• Boiling point: 470.867°C at 760 mmHg (Cal.)
• Flash point: 238.572°C (Cal.)