(3,5-Bis(trifluoromethyl)phenyl)boronic acid

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Catalog Number
ACM73852194
Product Name
(3,5-Bis(trifluoromethyl)phenyl)boronic acid
Structure
Structure
CAS
73852-19-4
Category
Heterocyclic Organic Compound
Synonyms
CB-110; 3,5-Bis-trifluoromethylphenylboronic acid; (3,5-Bis(trifluoromethyl)phenyl)boronic acid; ST2414244; SCHEMBL126169; AKOS000285053; Boronic acid, [3,5-bis(trifluoromethyl)phenyl]-; 133412-EP2295406A1; ZINC169743211; 3,5-di(trifluoromethyl)-phenylboronic acid;
IUPAC Name
[3,5-bis(trifluoromethyl)phenyl]boronic acid;
Molecular Weight
257.926g/mol
Molecular Formula
C8H5BF6O2;
Canonical SMILES
B(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(O)O;
InChI
InChI=1S/C8H5BF6O2/c10-7(11,12)4-1-5(8(13,14)15)3-6(2-4)9(16)17/h1-3,16-17H;
InChI Key
BPTABBGLHGBJQR-UHFFFAOYSA-N;
Application
suzuki reaction
Complexity
242
Covalently-Bonded Unit Count
1
Exact Mass
258.029g/mol
H-Bond Acceptor
8
H-Bond Donor
2
Heavy Atom Count
17
Monoisotopic Mass
258.029g/mol
Rotatable Bond Count
1
Topological Polar Surface Area
40.5A^2
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