tert-Butyl2-hydroxy-1H-benzo[d]imidazole-1-carboxylate , 95% , 161468-45-7

CAS NO.：161468-45-7

Empirical Formula: C12H14N2O3

Molecular Weight: 234.25

MDL number: MFCD02179636

PRODUCT Properties

• Melting point: >250 °C
• Density: 1.237±0.06 g/cm3(Predicted)
• storage temp.: Sealed in dry,2-8°C
• solubility: Ethyl Acetate
• form: Solid
• pka: 10.57±0.30(Predicted)
• color: White
• InChI: InChI=1S/C12H14N2O3/c1-12(2,3)17-11(16)14-9-7-5-4-6-8(9)13-10(14)15/h4-7H,1-3H3,(H,13,15)
• InChIKey: GMUWCTKADZFKLT-UHFFFAOYSA-N
• SMILES: C1(=O)N(C(OC(C)(C)C)=O)C2=CC=CC=C2N1

Description and Uses

2-Oxo-2,3-dihydrobenzimidazole-1-carboxylic Acid tert-Butyl Ester is an substituent in the synthesis of Domperidone (D531100), a novel peripheral dopamine receptor antagonist that does not cross the blood-brain barrier and is used as an anti-emetic agent.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H315-H319-H335
• Precautionary statements: P261-P280-P301+P312-P302+P352-P305+P351+P338
• Hazard Codes: Xn
• Risk Statements: 20/21/22
• HS Code: 29225090