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Home > Boronic Acids > 1356109-90-4
1356109-90-4 | (6-(2,2,2-Trifluoroethyl)pyridin-3-yl)boronic acid
CAS No: 1356109-90-4 Catalog No: AG003A55 MDL No:
Product Description
Catalog Number:
AG003A55
Chemical Name:
(6-(2,2,2-Trifluoroethyl)pyridin-3-yl)boronic acid
CAS Number:
1356109-90-4
Molecular Formula:
C7H7BF3NO2
Molecular Weight:
204.9422
IUPAC Name:
[6-(2,2,2-trifluoroethyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C7H7BF3NO2/c9-7(10,11)3-6-2-1-5(4-12-6)8(13)14/h1-2,4,13-14H,3H2
InChI Key:
AHBQIJFNXQLAIJ-UHFFFAOYSA-N
SMILES:
OB(c1ccc(nc1)CC(F)(F)F)O
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.052g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.943g/mol
Monoisotopic Mass:
205.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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