2-(Acetylcysteine)-N-Isopropylacetanilide
[CAS# 58403-00-2]

Identification

• Name: 2-(Acetylcysteine)-N-Isopropylacetanilide
• Synonyms: (2R)-2-Acetamido-3-[2-(Isopropyl-Phenyl-Amino)-2-Oxo-Ethyl]Sulfanyl-Propanoic Acid; (2R)-2-Acetamido-3-[[2-(Isopropyl-Phenylamino)-2-Oxoethyl]Thio]Propanoic Acid; (2R)-2-Acetamido-3-[[2-(Isopropyl-Phenyl-Amino)-2-Keto-Ethyl]Thio]Propionic Acid
• Molecular Formula: C₁₆H₂₂N₂O₄S
• Molecular Weight: 338.42
• CAS Registry Number: 58403-00-2
• SMILES: [C@H](C(=O)O)(NC(=O)C)CSCC(=O)N(C1=CC=CC=C1)C(C)C
• InChI: 1S/C16H22N2O4S/c1-11(2)18(13-7-5-4-6-8-13)15(20)10-23-9-14(16(21)22)17-12(3)19/h4-8,11,14H,9-10H2,1-3H3,(H,17,19)(H,21,22)/t14-/m0/s1
• InChIKey: BLNXLKHGHLFYJT-AWEZNQCLSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 569.52°C at 760 mmHg (Cal.)
• Flash point: 298.235°C (Cal.)