(2S)-4-Carbamoyl-2-[(4-Chloro-3-Oxo-Butan-2-Yl)Amino]Butanoic Acid
[CAS# 91255-01-5]

Identification

• Name: (2S)-4-Carbamoyl-2-[(4-Chloro-3-Oxo-Butan-2-Yl)Amino]Butanoic Acid
• Synonyms: (2S)-5-Amino-2-[(3-Chloro-1-Methyl-2-Oxo-Propyl)Amino]-5-Oxo-Pentanoic Acid; (2S)-5-Amino-2-[(3-Chloro-1-Methyl-2-Oxopropyl)Amino]-5-Oxopentanoic Acid; (2S)-5-Amino-2-[(3-Chloro-2-Keto-1-Methyl-Propyl)Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₉H₁₅ClN₂O₄
• Molecular Weight: 250.68
• CAS Registry Number: 91255-01-5
• SMILES: [C@H](C(=O)O)(NC(C(CCl)=O)C)CCC(=O)N
• InChI: 1S/C9H15ClN2O4/c1-5(7(13)4-10)12-6(9(15)16)2-3-8(11)14/h5-6,12H,2-4H2,1H3,(H2,11,14)(H,15,16)/t5?,6-/m0/s1
• InChIKey: LEKFEHXLFZIDCP-GDVGLLTNSA-N

Properties

• Density: 1.315g/cm³ (Cal.)
• Boiling point: 511.548°C at 760 mmHg (Cal.)
• Flash point: 263.175°C (Cal.)