Benzyl 4-[(2S)-2-Amino-2-[[(1S)-1-(1,2-Dibromoethoxycarbonyl)Ethyl]Carbamoyl]Ethyl]Benzoate
[CAS# 73680-50-9]

Identification

• Name: Benzyl 4-[(2S)-2-Amino-2-[[(1S)-1-(1,2-Dibromoethoxycarbonyl)Ethyl]Carbamoyl]Ethyl]Benzoate
• Synonyms: Phenylmethyl 4-[(2S)-2-Amino-3-[[(1S)-2-(1,2-Dibromoethoxy)-1-Methyl-2-Oxo-Ethyl]Amino]-3-Oxo-Propyl]Benzoate; 4-[(2S)-2-Amino-3-[[(1S)-2-(1,2-Dibromoethoxy)-1-Methyl-2-Oxoethyl]Amino]-3-Oxopropyl]Benzoic Acid Phenylmethyl Ester; 4-[(2S)-2-Amino-3-[[(1S)-2-(1,2-Dibromoethoxy)-2-Keto-1-Methyl-Ethyl]Amino]-3-Keto-Propyl]Benzoic Acid Benzyl Ester
• Molecular Formula: C₂₂H₂₄Br₂N₂O₅
• Molecular Weight: 556.25
• CAS Registry Number: 73680-50-9
• SMILES: [C@H](C(=O)OC(CBr)Br)(NC([C@@H](N)CC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)=O)C
• InChI: 1S/C22H24Br2N2O5/c1-14(21(28)31-19(24)12-23)26-20(27)18(25)11-15-7-9-17(10-8-15)22(29)30-13-16-5-3-2-4-6-16/h2-10,14,18-19H,11-13,25H2,1H3,(H,26,27)/t14-,18-,19?/m0/s1
• InChIKey: SKAKZUMHXDPPDO-ZWSMLAFMSA-N

Properties

• Density: 1.543g/cm³ (Cal.)
• Boiling point: 680.889°C at 760 mmHg (Cal.)
• Flash point: 365.589°C (Cal.)