CAS
1107603-52-0 Purity
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1107603-52-0 Purity
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The molecular formula is C6H5BF2O3.
The synonyms are 1132666-81-9, (3,5-Difluoro-4-hydroxyphenyl)boronic acid, MFCD17011981, SCHEMBL1277215.
The molecular weight is 173.91 g/mol.
The IUPAC name is (3,5-difluoro-4-hydroxyphenyl)boronic acid.
The InChI is InChI=1S/C6H5BF2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10-12H.
The InChIKey is ZLSDOFHBADFRMF-UHFFFAOYSA-N.
The Canonical SMILES is B(C1=CC(=C(C(=C1)F)O)F)(O)O.
The CAS number is 1132666-81-9.
Yes, it is a canonicalized compound according to PubChem.