(4S)-6-(2,6-Dichlorobenzoyl)Oxy-5-Oxo-4-(Phenylmethoxycarbonylamino)Hexanoic Acid
[CAS# 153088-75-6]

Identification

• Name: (4S)-6-(2,6-Dichlorobenzoyl)Oxy-5-Oxo-4-(Phenylmethoxycarbonylamino)Hexanoic Acid
• Synonyms: (4S)-6-[(2,6-Dichlorophenyl)-Oxomethoxy]-5-Oxo-4-[[Oxo-(Phenylmethoxy)Methyl]Amino]Hexanoic Acid; (4S)-4-(Benzyloxycarbonylamino)-6-(2,6-Dichlorobenzoyl)Oxy-5-Keto-Hexanoic Acid; (4S)-6-(2,6-Dichlorophenyl)Carbonyloxy-5-Oxo-4-(Phenylmethoxycarbonylamino)Hexanoic Acid
• Molecular Formula: C₂₁H₁₉Cl₂NO₇
• Molecular Weight: 468.29
• CAS Registry Number: 153088-75-6
• SMILES: [C@@H](NC(OCC1=CC=CC=C1)=O)(C(=O)COC(=O)C2=C(Cl)C=CC=C2Cl)CCC(=O)O
• InChI: 1S/C21H19Cl2NO7/c22-14-7-4-8-15(23)19(14)20(28)30-12-17(25)16(9-10-18(26)27)24-21(29)31-11-13-5-2-1-3-6-13/h1-8,16H,9-12H2,(H,24,29)(H,26,27)/t16-/m0/s1
• InChIKey: PJUJOVPKUAZVRY-INIZCTEOSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 690.818°C at 760 mmHg (Cal.)
• Flash point: 371.594°C (Cal.)