B(C1=CC(=CC=C1)OC(F)(F)F)(O)O
CAS: 179113-90-7
Nom: [3-(trifluoromethoxy)phenyl]boronic acid
SMILES: B(C1=CC(=CC=C1)OC(F)(F)F)(O)O

Molecular Processing

Molecular formula
C7H6BF3O3
Molecular weight
205.93
Exact mass
206.0362
XLogP
0.26
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
42.95

Supplementary Information

InChIKey: UWDFWVLAHRQSKK-UHFFFAOYSA-N
Synonymes
3-(Trifluoromethoxy)phenylboronic acid (contains varying amounts of Anhydride)RefChem:496304642-464-2179113-90-73-(Trifluoromethoxy)phenylboronic acid3-Trifluoromethoxyphenylboronic acid(3-(Trifluoromethoxy)phenyl)boronic acid3-(Trifluoromethoxy)benzeneboronic Acid[3-(trifluoromethoxy)phenyl]boronic AcidMFCD01320697Boronic acid, B-[3-(trifluoromethoxy)phenyl]-3-(trifluoromethoxy)phenyl boronic acid3-(trifluoromethyloxy)phenylboronic acidBoronic acid, [3-(trifluoromethoxy)phenyl]-m-(trifluoromethoxy)phenylboronic acidSCHEMBL28261SCHEMBL28433013DTXSID403702743-trifluoromethoxybenzeneboronic acid3-trifluoromethoxy-phenylboronic acid3-trifluoromethoxyphenyl boronic acidSBB0935583-Trifluoromethoxy-benzeneboronic acid3-trifluoromethoxybenzene boronic acid3-trifluoromethoxylphenyl boronic acid3-trifluoromethoxy-phenyl boronic acidAKOS004116215AB09003AC-5362CS-W015357
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Recherche Etendue

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