2-fluoro-4-methylphenylboronic acid MIDA ester

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Catalog Number

ACMA00015368

Product Name

2-fluoro-4-methylphenylboronic acid MIDA ester

Category

Salt

IUPAC Name

2-(2-fluoro-4-methylphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Molecular Weight

265.05g/mol

Molecular Formula

C12H13BFNO4

Canonical SMILES

B1(OC(=O)CN(CC(=O)O1)C)C2=C(C=C(C=C2)C)F

InChI

InChI=1S/C12H13BFNO4/c1-8-3-4-9(10(14)5-8)13-18-11(16)6-15(2)7-12(17)19-13/h3-5H,6-7H2,1-2H3

InChI Key

NAIYXIBAIMFIER-UHFFFAOYSA-N

Complexity

348

Covalently-Bonded Unit Count

Exact Mass

265.092166g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

265.092166g/mol

Rotatable Bond Count

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