Sodium [2S-[2alpha,5alpha,6beta(S*)]]-6-(2,2-Dimethyl-5-Oxo-4-Phenylimidazolidin-1-Yl)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
[CAS# 54450-67-8]

Identification

• Name: Sodium [2S-[2alpha,5alpha,6beta(S*)]]-6-(2,2-Dimethyl-5-Oxo-4-Phenylimidazolidin-1-Yl)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
• Synonyms: Sodium 6-(2,2-Dimethyl-5-Oxo-4-Phenyl-Imidazolidin-1-Yl)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Sodium 6-(2,2-Dimethyl-5-Oxo-4-Phenyl-1-Imidazolidinyl)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Sodium 7-Keto-6-(5-Keto-2,2-Dimethyl-4-Phenyl-Imidazolidin-1-Yl)-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
• Molecular Formula: C₁₉H₂₂N₃NaO₄S
• Molecular Weight: 411.45
• CAS Registry Number: 54450-67-8
• EINECS: 259-168-0
• SMILES: C4=C(C3NC(N(C2C1SC(C(N1C2=O)C([O-])=O)(C)C)C3=O)(C)C)C=CC=C4.[Na+]
• InChI: 1S/C19H23N3O4S.Na/c1-18(2)13(17(25)26)21-15(24)12(16(21)27-18)22-14(23)11(20-19(22,3)4)10-8-6-5-7-9-10;/h5-9,11-13,16,20H,1-4H3,(H,25,26);/q;+1/p-1
• InChIKey: JGCRRHYEUGXAOJ-UHFFFAOYSA-M

Properties

• Boiling point: 648.4°C at 760 mmHg (Cal.)
• Flash point: 345.9°C (Cal.)