2-Amino-4-Oxo-6,7-Dihydro-5H-1,3-Thiazepine-6-Carboxylic Acid
[CAS# 34488-27-2]

Identification

• Name: 2-Amino-4-Oxo-6,7-Dihydro-5H-1,3-Thiazepine-6-Carboxylic Acid
• Molecular Formula: C₆H₈N₂O₃S
• Molecular Weight: 188.20
• CAS Registry Number: 34488-27-2
• SMILES: O=C(O)C1CC(=O)/N=C(/N)SC1
• InChI: 1S/C6H8N2O3S/c7-6-8-4(9)1-3(2-12-6)5(10)11/h3H,1-2H2,(H,10,11)(H2,7,8,9)
• InChIKey: NWCNBXNJNAJTCO-UHFFFAOYSA-N

Properties

• Density: 1.736g/cm³ (Cal.)
• Boiling point: 447.587°C at 760 mmHg (Cal.)
• Flash point: 224.493°C (Cal.)