Home Boronic acids (2,6-Bis(trifluoromethyl)phenyl)boronic acid

(2,6-Bis(trifluoromethyl)phenyl)boronic acid

CAS No.:
681812-07-7
Catalog Number:
AG0036LU
Molecular Formula:
C8H5BF6O2
Molecular Weight:
257.9255
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Product Description
Catalog Number:
AG0036LU
Chemical Name:
(2,6-Bis(trifluoromethyl)phenyl)boronic acid
CAS Number:
681812-07-7
Molecular Formula:
C8H5BF6O2
Molecular Weight:
257.9255
MDL Number:
MFCD04039321
IUPAC Name:
[2,6-bis(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H5BF6O2/c10-7(11,12)4-2-1-3-5(8(13,14)15)6(4)9(16)17/h1-3,16-17H
InChI Key:
WAMPGNNEOZGBHR-UHFFFAOYSA-N
SMILES:
OB(c1c(cccc1C(F)(F)F)C(F)(F)F)O
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.029g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.926g/mol
Monoisotopic Mass:
258.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties