Cephapirin Lactone
[CAS# 60517-75-1]

Identification

• Name: Cephapirin Lactone
• Synonyms: Acetamide, 2-(4-Pyridinylthio)-N-(1,4,5A,6-Tetrahydro-1,7-Dioxo-3H,7H-Azeto(2,1-B)Furo(3,4-D)(1,3)Thiazin-6-Yl)-, (6R-Trans)-; Cephapirin Lactone; Deacetylcephapirin Lactone
• Molecular Formula: C₁₅H₁₃N₃O₄S₂
• Molecular Weight: 363.41
• CAS Registry Number: 60517-75-1
• SMILES: [C@H]12SCC4=C(N1C(=O)[C@H]2NC(=O)CSC3=CC=NC=C3)C(OC4)=O
• InChI: 1S/C15H13N3O4S2/c19-10(7-23-9-1-3-16-4-2-9)17-11-13(20)18-12-8(5-22-15(12)21)6-24-14(11)18/h1-4,11,14H,5-7H2,(H,17,19)/t11-,14-/m1/s1
• InChIKey: LINJTNNYPFWNIF-BXUZGUMPSA-N

Properties

• Density: 1.624g/cm³ (Cal.)
• Boiling point: 829.07°C at 760 mmHg (Cal.)
• Flash point: 455.205°C (Cal.)