(2R,6R,7R)-7-Amino-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-3-Ene-2-Carboxylic Acid
[CAS# 102044-68-8]

Identification

• Name: (2R,6R,7R)-7-Amino-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-3-Ene-2-Carboxylic Acid
• Synonyms: (2R,6R,7R)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid
• Molecular Formula: C₇H₈N₂O₃S
• Molecular Weight: 200.21
• CAS Registry Number: 102044-68-8
• SMILES: C1=CS[C@@H]2[C@@H](C(=O)N2[C@H]1C(=O)O)N
• InChI: 1S/C7H8N2O3S/c8-4-5(10)9-3(7(11)12)1-2-13-6(4)9/h1-4,6H,8H2,(H,11,12)/t3-,4-,6-/m1/s1
• InChIKey: PDTVGZMBPPXMAO-ZMIZWQJLSA-N

Properties

• Density: 1.688g/cm³ (Cal.)
• Boiling point: 531.227°C at 760 mmHg (Cal.)
• Flash point: 275.077°C (Cal.)
• Refractive index: 1.733 (Cal.)