3,5-Dimethylisoxazole-4-boronic acid

• CAS: 16114-47-9
• Catalog Number: ACM16114479
• Category: Other Products
• Molecular Weight: 140.94g/mol
• Molecular Formula: C5H8BNO3
• IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)boronic acid
• Canonical SMILES: B(C1=C(ON=C1C)C)(O)O
• InChI: InChI=1S/C5H8BNO3/c1-3-5(6(8)9)4(2)10-7-3/h8-9H,1-2H3
• InChI Key: DIIFZCPZIRQDIJ-UHFFFAOYSA-N
• Complexity: 122
• Covalently-Bonded Unit Count: 1
• Exact Mass: 141.059723g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 10
• Monoisotopic Mass: 141.059723g/mol
• Rotatable Bond Count: 1

Synthetic Use

Upstream Synthesis Route 1

• 10558-25-5
• 5419-55-6

• 16114-47-9

Reference: [1] Patent: WO2012/11125, 2012, A1, . Location in patent: Page/Page column 148-149

Upstream Synthesis Route 2

• 300-87-8

• 16114-47-9

Reference: [1] Patent: WO2012/11125, 2012, A1,

Upstream Synthesis Route 3

• 10557-85-4

• 16114-47-9

Reference: [1]Journal of Organometallic Chemistry,1967,vol. 9,p. 19 - 22

Downstream Synthesis Route 1

• 16114-47-9

• 10557-85-4

Reference: [1] Journal of Organometallic Chemistry, 1967, vol. 9, # 1, p. 19 - 22

Downstream Synthesis Route 2

• 16114-47-9

• 10557-85-4

Reference: [1]Journal of Organometallic Chemistry,1967,vol. 9,p. 19 - 22

* For details of the synthesis route, please refer to the original source to ensure accuracy.