2-Methoxy-5-(trifluoromethyl)phenylboronic acid

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Catalog Number
ACM240139826
Product Name
2-Methoxy-5-(trifluoromethyl)phenylboronic acid
Structure
Structure
CAS
240139-82-6
Category
Boronic Acids
IUPAC Name
[2-methoxy-5-(trifluoromethyl)phenyl]boronic acid
Molecular Weight
219.96g/mol
Molecular Formula
C8H8BF3O3
Canonical SMILES
B(C1=C(C=CC(=C1)C(F)(F)F)OC)(O)O
InChI
InChI=1S/C8H8BF3O3/c1-15-7-3-2-5(8(10,11)12)4-6(7)9(13)14/h2-4,13-14H,1H3
InChI Key
PXDQUMRSSQYJSX-UHFFFAOYSA-N
Complexity
210
Covalently-Bonded Unit Count
1
Exact Mass
220.051859g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
15
Monoisotopic Mass
220.051859g/mol
Rotatable Bond Count
2
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