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Structure

4-Methoxy-2-(trifluoromethyl)phenylboronic acid

CAS
313546-16-6
Catalog Number
ACM313546166
Category
Boronic Acids
Molecular Weight
219.96g/mol
Molecular Formula
C8H8BF3O3

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Specification

Synonyms
4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORONIC ACID;4-METHOXY-2-(TRIFLUOROMETHYL)BENZENEBORONIC ACID;4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORO&;4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBRONIC ACID;2-Borono-5-methoxybenzotrifluoride, 4-Borono-3-(trifluoromethyl)anisol
IUPAC Name
[4-methoxy-2-(trifluoromethyl)phenyl]boronic acid
Canonical SMILES
B(C1=C(C=C(C=C1)OC)C(F)(F)F)(O)O
InChI
InChI=1S/C8H8BF3O3/c1-15-5-2-3-7(9(13)14)6(4-5)8(10,11)12/h2-4,13-14H,1H3
InChI Key
ZBCRZEJNAADYKG-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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