(6R,7R)-7-Amino-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
[CAS# 72079-40-4]

Identification

• Name: (6R,7R)-7-Amino-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• Synonyms: (6R,7R)-7-amino-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• Molecular Formula: C₇H₈N₂O₃S
• Molecular Weight: 200.21
• CAS Registry Number: 72079-40-4
• SMILES: O=C2N1/C(=C\SC[C@H]1[C@H]2N)C(O)=O
• InChI: 1S/C7H8N2O3S/c8-5-3-1-13-2-4(7(11)12)9(3)6(5)10/h2-3,5H,1,8H2,(H,11,12)/t3-,5+/m0/s1
• InChIKey: KIRFVDFHFNTXGO-WVZVXSGGSA-N

Properties

• Density: 1.699g/cm³ (Cal.)
• Boiling point: 453.726°C at 760 mmHg (Cal.)
• Flash point: 228.206°C (Cal.)