Anticapsin
[CAS# 28978-07-6]

Identification

• Name: Anticapsin
• Synonyms: (2S)-2-Amino-3-[(1R,2R,6R)-5-Keto-7-Oxabicyclo[4.1.0]Heptan-2-Yl]Propionic Acid; 7-Oxabicyclo(4.1.0)Heptane-2-Propanoic Acid, Alpha-Amino-5-Oxo-, (1R-(1Alpha,2Beta(S*),6Alpha))-; Anticapsin
• Molecular Formula: C₉H₁₃NO₄
• Molecular Weight: 199.21
• CAS Registry Number: 28978-07-6
• SMILES: [C@H]12O[C@H]1C(=O)CC[C@@H]2C[C@H](N)C(=O)O
• InChI: 1S/C9H13NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-5,7-8H,1-3,10H2,(H,12,13)/t4-,5+,7-,8+/m1/s1
• InChIKey: KHVZXXWDPSCGEK-ROHCDXGRSA-N

Properties

• Density: 1.369g/cm³ (Cal.)
• Boiling point: 415.857°C at 760 mmHg (Cal.)
• Flash point: 205.303°C (Cal.)