4-[4'-(Trifluoromethoxy)phenoxymethyl]phenylboronic acid

Name: 4-[4'-(Trifluoromethoxy)phenoxymethyl]phenylboronic acid
SKU: ACM870778975-1
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Catalog NumberACM870778975-1

CAS Number870778-97-5

CategorySalt

IUPAC Name

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

Molecular Weight

312.05g/mol

Molecular Formula

C14H12BF3O4

Canonical SMILES

B(C1=CC=C(C=C1)COC2=CC=C(C=C2)OC(F)(F)F)(O)O

InChI

InChI=1S/C14H12BF3O4/c16-14(17,18)22-13-7-5-12(6-8-13)21-9-10-1-3-11(4-2-10)15(19)20/h1-8,19-20H,9H2

InChI Key

BAJVPURXOFJFRW-UHFFFAOYSA-N

Complexity

325

Covalently-Bonded Unit Count

Exact Mass

312.078074g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

312.078074g/mol

Rotatable Bond Count

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