[(2,2-Dimethylpropanoyl)Oxy]Methyl 7-Acetamido-3-[(5-Methyl-2H-Tetrazol-2-Yl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-3-Ene-2-Carboxylate
[CAS# 104712-44-9]

Identification

• Name: [(2,2-Dimethylpropanoyl)Oxy]Methyl 7-Acetamido-3-[(5-Methyl-2H-Tetrazol-2-Yl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-3-Ene-2-Carboxylate
• Synonyms: [(2,2-Dimethylpropanoyl)oxy]methyl 7-acetamido-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate; [(2,2-Dimethylpropanoyl)oxy]methyl-7-acetamido-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-en-2-carboxylat
• Molecular Formula: C₁₈H₂₄N₆O₆S
• Molecular Weight: 452.48
• CAS Registry Number: 104712-44-9
• SMILES: Cc1nnn(n1)CC2=CSC3C(C(=O)N3C2C(=O)OCOC(=O)C(C)(C)C)NC(=O)C
• InChI: 1S/C18H24N6O6S/c1-9-20-22-23(21-9)6-11-7-31-15-12(19-10(2)25)14(26)24(15)13(11)16(27)29-8-30-17(28)18(3,4)5/h7,12-13,15H,6,8H2,1-5H3,(H,19,25)
• InChIKey: CZRLOSRCPTVWPC-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Refractive index: 1.682 (Cal.)