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Home > Boronic Acids > 136466-94-9
136466-94-9 | Boronic acid, B-(2,6-difluoro-3-pyridinyl)-
CAS No: 136466-94-9 Catalog No: AG0011VK MDL No:MFCD06657881
Product Description
Catalog Number:
AG0011VK
Chemical Name:
Boronic acid, B-(2,6-difluoro-3-pyridinyl)-
CAS Number:
136466-94-9
Molecular Formula:
C5H4BF2NO2
Molecular Weight:
158.8986
MDL Number:
MFCD06657881
IUPAC Name:
(2,6-difluoropyridin-3-yl)boronic acid
InChI:
InChI=1S/C5H4BF2NO2/c7-4-2-1-3(6(10)11)5(8)9-4/h1-2,10-11H
InChI Key:
LCCZTROJRJFXNV-UHFFFAOYSA-N
SMILES:
OB(c1ccc(nc1F)F)O
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.03g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.899g/mol
Monoisotopic Mass:
159.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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