(2S)-6-Amino-2-[[(2R)-2-Amino-3-(Carboxymethylsulfanyl)Propanoyl]Amino]Hexanoic Acid
[CAS# 82951-55-1]

Identification

• Name: (2S)-6-Amino-2-[[(2R)-2-Amino-3-(Carboxymethylsulfanyl)Propanoyl]Amino]Hexanoic Acid
• Synonyms: (2S)-6-Amino-2-[[(2R)-2-Amino-3-(Carboxymethylthio)-1-Oxopropyl]Amino]Hexanoic Acid; (2S)-6-Amino-2-[[(2R)-2-Amino-3-(Carboxymethylthio)Propanoyl]Amino]Hexanoic Acid; Carbocysteine-Lysine
• Molecular Formula: C₁₁H₂₁N₃O₅S
• Molecular Weight: 307.36
• CAS Registry Number: 82951-55-1
• SMILES: [C@H](C(=O)O)(NC([C@@H](N)CSCC(=O)O)=O)CCCCN
• InChI: 1S/C11H21N3O5S/c12-4-2-1-3-8(11(18)19)14-10(17)7(13)5-20-6-9(15)16/h7-8H,1-6,12-13H2,(H,14,17)(H,15,16)(H,18,19)/t7-,8-/m0/s1
• InChIKey: ZXFWVUHYOBPQHY-YUMQZZPRSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 636.51°C at 760 mmHg (Cal.)
• Flash point: 338.749°C (Cal.)