(2S,5R)-Benzhydryl 3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4-oxide , 95% , 87579-78-0

CAS NO.：87579-78-0

Empirical Formula: C21H21NO4S

Molecular Weight: 383.46

MDL number:

PRODUCT Properties

• Boiling point: 598.7±50.0 °C(Predicted)
• Density: 1.37
• storage temp.: 2-8°C
• solubility: Dichloromethane
• form: Solid
• pka: -3.44±0.60(Predicted)
• color: Yellow
• InChI: InChI=1S/C21H21NO4S/c1-21(2)19(22-16(23)13-17(22)27(21)25)20(24)26-18(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,17-19H,13H2,1-2H3/t17-,19+,27?/m1/s1
• InChIKey: AZIUCAWYSMPKQK-HVHNRQALSA-N
• SMILES: N12[C@@]([H])(CC1=O)S(=O)C(C)(C)[C@@H]2C(OC(C1=CC=CC=C1)C1=CC=CC=C1)=O

Description and Uses

(2S,5R)-3,3-dimethyl-7-oxo-4-oxide-4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Diphenylmethyl Ester is an intermediate in the synthesis of Tazobactam Sodium Salt-13C2,15N1, which is the labelled analogue of Tazobactam Sodium Salt (T010100), which is a β-Lactamase inhibitor, used with β-lactam antibiotics to enhance their effect.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H315-H319-H335
• Precautionary statements: P261-P305+P351+P338