4-Isoxazoleboronic acid pinacol ester

• Catalog Number: ACM928664986
• Product Name: 4-Isoxazoleboronic acid pinacol ester
• CAS: 928664-98-6
• Category: Heterocyclic Organic Compound
• IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
• Molecular Weight: 195.0245
• Molecular Formula: C9H14BNO3
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CON=C2
• InChI: InChI=1S/C9H14BNO3/c1-8(2)9(3,4)14-10(13-8)7-5-11-12-6-7/h5-6H,1-4H3
• InChI Key: LXCICYRNWIGDQA-UHFFFAOYSA-N
• Complexity: 216
• Covalently-Bonded Unit Count: 1
• Exact Mass: 195.106673g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 14
• MDL Number: MFCD06657891
• Monoisotopic Mass: 195.106673g/mol
• Rotatable Bond Count: 1
• Size: 100mg,250mg,500mg,1g,5g,25g,100g

Custom Reviews

May 23, 2023

An important pharmaceutical intermediate.

Difluoromethyl modified 4-Isoxazoleboronic acid pinacol ester has high efficacy and low biological toxicity against hepatitis C virus.