(cis-2-(Bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methylbenzoate , 95% , 61397-56-6

CAS NO.：61397-56-6

Empirical Formula: C18H15BrCl2O4

Molecular Weight: 446.12

MDL number: MFCD07370171

EINECS: 262-765-9

PRODUCT Properties

• Melting point: 116-117 °C(Solv: ethanol (64-17-5))
• Boiling point: 517.0±50.0 °C(Predicted)
• Density: 1.512±0.06 g/cm3(Predicted)
• storage temp.: -20°C Freezer, Under Inert Atmosphere
• solubility: Chloroform (Slightly), Methanol (Slightly)
• form: Solid
• color: White
• Water Solubility: 12μg/L at 20℃
• InChI: InChI=1S/C18H15BrCl2O4/c1-23-17(22)13-5-3-2-4-12(13)16-9-24-18(10-19,25-16)14-7-6-11(20)8-15(14)21/h2-8,16H,9-10H2,1H3
• InChIKey: ALDNTQXBYHYCPK-UHFFFAOYSA-N
• SMILES: C(OC)(=O)C1=CC=CC=C1C1COC(CBr)(C2=CC=C(Cl)C=C2Cl)O1
• LogP: 5.8
• CAS DataBase Reference: 61397-56-6(CAS DataBase Reference)

Description and Uses

cis-[2-Bromomethyl-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl Benzoate is an intermediate in the preparation of antifungal agents such as Ketoconazole (K186000), Itraconazole (I937500) and Tercon azole.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H312-H315-H319
• Precautionary statements: P280-P305+P351+P338