(3S)-3-Amino-4-Oxo-4-[(1S)-1-Propoxycarbonyl-2-Azabicyclo[3.1.0]Hexan-2-Yl]Butanoic Acid
[CAS# 134732-59-5]

Identification

• Name: (3S)-3-Amino-4-Oxo-4-[(1S)-1-Propoxycarbonyl-2-Azabicyclo[3.1.0]Hexan-2-Yl]Butanoic Acid
• Synonyms: (3S)-3-Amino-4-Oxo-4-[(1S)-1-(Oxo-Propoxymethyl)-2-Azabicyclo[3.1.0]Hexan-2-Yl]Butanoic Acid; (3S)-3-Amino-4-Keto-4-[(1S)-1-Propoxycarbonyl-2-Azabicyclo[3.1.0]Hexan-2-Yl]Butyric Acid; Asp-2,3-Mepro-Opr
• Molecular Formula: C₁₃H₂₀N₂O₅
• Molecular Weight: 284.31
• CAS Registry Number: 134732-59-5
• SMILES: [C@@]12(C(=O)OCCC)N(CCC1C2)C([C@@H](N)CC(=O)O)=O
• InChI: 1S/C13H20N2O5/c1-2-5-20-12(19)13-7-8(13)3-4-15(13)11(18)9(14)6-10(16)17/h8-9H,2-7,14H2,1H3,(H,16,17)/t8?,9-,13-/m0/s1
• InChIKey: SNJZXFDYOLIBOC-JDRUZZMFSA-N

Properties

• Density: 1.374g/cm³ (Cal.)
• Boiling point: 471.932°C at 760 mmHg (Cal.)
• Flash point: 239.216°C (Cal.)