2-Methyl-2-Propanyl (7Z)-7-(2-Amino-1,3-Thiazol-4-Yl)-4-Ethoxy-10,10-Dimethyl-6-Oxo-3,5,9-Trioxa-8-Aza-4-Phosphaundec-7-En-11-Oate 4-Oxide
[CAS# 179258-52-7]

Identification

• Name: 2-Methyl-2-Propanyl (7Z)-7-(2-Amino-1,3-Thiazol-4-Yl)-4-Ethoxy-10,10-Dimethyl-6-Oxo-3,5,9-Trioxa-8-Aza-4-Phosphaundec-7-En-11-Oate 4-Oxide
• Synonyms: O,O-Diethylphosphoryl (Z)-2-(2-aminothiazol-4-yl)-2-(1-t-butoxycarbonyl-1-methyl)ethoxyiminoacetate
• Molecular Formula: C₁₇H₂₈N₃O₈PS
• Molecular Weight: 465.46
• CAS Registry Number: 179258-52-7
• SMILES: O=P(OCC)(OCC)OC(=O)C(=N\OC(C(=O)OC(C)(C)C)(C)C)/c1nc(sc1)N
• InChI: 1S/C17H28N3O8PS/c1-8-24-29(23,25-9-2)27-13(21)12(11-10-30-15(18)19-11)20-28-17(6,7)14(22)26-16(3,4)5/h10H,8-9H2,1-7H3,(H2,18,19)/b20-12-
• InChIKey: PEBPIOCFTYBZMA-NDENLUEZSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 533.854°C at 760 mmHg (Cal.)
• Flash point: 276.665°C (Cal.)
• Refractive index: 1.547 (Cal.)