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Home > Boronic Acids > 1072944-17-2
1072944-17-2 | (2-Hydroxy-3-(trifluoromethyl)phenyl)boronic acid
CAS No: 1072944-17-2 Catalog No: AG007T7N MDL No:MFCD08689548
Product Description
Catalog Number:
AG007T7N
Chemical Name:
(2-Hydroxy-3-(trifluoromethyl)phenyl)boronic acid
CAS Number:
1072944-17-2
Molecular Formula:
C7H6BF3O3
Molecular Weight:
205.9269
MDL Number:
MFCD08689548
IUPAC Name:
[2-hydroxy-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H6BF3O3/c9-7(10,11)4-2-1-3-5(6(4)12)8(13)14/h1-3,12-14H
InChI Key:
PDKFKKGOOLKAGR-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1O)C(F)(F)F)O
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
205.927g/mol
Monoisotopic Mass:
206.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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