Home Boronic acids (5-(trifluoromethoxy)pyridin-3-yl)boronic acid

(5-(trifluoromethoxy)pyridin-3-yl)boronic acid

CAS No.:
1293389-50-0
Catalog Number:
AG01EKWN
Molecular Formula:
C6H5BF3NO3
Molecular Weight:
206.9150
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Product Description
Catalog Number:
AG01EKWN
Chemical Name:
(5-(trifluoromethoxy)pyridin-3-yl)boronic acid
CAS Number:
1293389-50-0
Molecular Formula:
C6H5BF3NO3
Molecular Weight:
206.9150
MDL Number:
MFCD10698607
IUPAC Name:
[5-(trifluoromethoxy)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C6H5BF3NO3/c8-6(9,10)14-5-1-4(7(12)13)2-11-3-5/h1-3,12-13H
InChI Key:
BITCKTNTOZHVSE-UHFFFAOYSA-N
SMILES:
OB(c1cncc(c1)OC(F)(F)F)O
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.915g/mol
Monoisotopic Mass:
207.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties