Ethyl (4S)-7-{[(Benzyloxy)Carbonyl]Amino}-4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-Oxoheptanoate
[CAS# 150618-12-5]

Identification

• Name: Ethyl (4S)-7-{[(Benzyloxy)Carbonyl]Amino}-4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-Oxoheptanoate
• Synonyms: Ethyl 4(S)-Boc-amino-7-Cbz-amino-3-oxo-heptanoate
• Molecular Formula: C₂₂H₃₂N₂O₇
• Molecular Weight: 436.50
• CAS Registry Number: 150618-12-5
• SMILES: CCOC(=O)CC(=O)C(CCCNC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C
• InChI: 1S/C22H32N2O7/c1-5-29-19(26)14-18(25)17(24-21(28)31-22(2,3)4)12-9-13-23-20(27)30-15-16-10-7-6-8-11-16/h6-8,10-11,17H,5,9,12-15H2,1-4H3,(H,23,27)(H,24,28)/t17-/m0/s1
• InChIKey: BVSQWZNXUCGKIW-KRWDZBQOSA-N

Properties

• Density: 1.152g/cm³ (Cal.)
• Boiling point: 604.928°C at 760 mmHg (Cal.)
• Flash point: 319.649°C (Cal.)
• Refractive index: 1.509 (Cal.)