3-Methyl-4-trifluoromethoxyphenylboronic acid

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Catalog Number

ACMA00015070

Product Name

3-Methyl-4-trifluoromethoxyphenylboronic acid

Category

Salt

IUPAC Name

[3-methyl-4-(trifluoromethoxy)phenyl]boronic acid

Molecular Weight

219.96g/mol

Molecular Formula

C8H8BF3O3

Canonical SMILES

B(C1=CC(=C(C=C1)OC(F)(F)F)C)(O)O

InChI

InChI=1S/C8H8BF3O3/c1-5-4-6(9(13)14)2-3-7(5)15-8(10,11)12/h2-4,13-14H,1H3

InChI Key

SSYRQCUQKJTPDJ-UHFFFAOYSA-N

Complexity

210

Covalently-Bonded Unit Count

Exact Mass

220.051859g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

220.051859g/mol

Rotatable Bond Count

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