2-fluoropyridine-4-boronic acid
Product Information
Molecular Formula
C5H5BFNO2
Molecular Weight
140.91
Description
2-fluoropyridine-4-boronic acid (CAS# 401815-98-3) is used to synthesize analogues of the antitubercular drug.
Synonyms
(2-fluoro-4-pyridinyl)boronic acid; (2-fluoropyridin-4-yl)boronic acid
IUPAC Name
(2-fluoropyridin-4-yl)boronic acid
SMILES
B(C1=CC(=NC=C1)F)(O)O
InChI
InChI=1S/C5H5BFNO2/c7-5-3-4(6(9)10)1-2-8-5/h1-3,9-10H
InChI Key
WXGBZJJAGLSBPR-UHFFFAOYSA-N
Boiling Point
326.8 °C at 760 mmHg
Flash Point
Not applicable
Purity
97 %
Density
1.34 g/cm3
LogP
-1.09950
Safety Information
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
141.0397367 g/mol
Monoisotopic Mass
141.0397367 g/mol
Topological Polar Surface Area
53.4Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
114
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113845515-A | Aromatic heterocyclic structure-containing dimethyl biphenyl diaryl pyrimidine derivative and preparation method and application thereof | 2021-09-03 |
| CN-113461666-A | Biphenyl diaryl methyl pyrimidine derivative containing aromatic heterocyclic structure and preparation method thereof | 2021-05-06 |
| US-2021403449-A1 | Biphenyl diaryl pyrimidine derivative with aromatic heterocyclic structure | 2021-03-08 |
| CN-113214247-A | Azaindole derivative marrow cell proliferation inhibitor, preparation method and application thereof in pharmacy | 2021-01-14 |
| CN-112724134-A | Azaindazole bipyridine derivative myeloid cell proliferation inhibitor, preparation method and application thereof in pharmacy | 2021-01-14 |
| CN-112687878-A | Electrochemical device and electronic device | 2020-12-25 |
| WO-2022043714-A1 | Gpr52 modulator compounds | 2020-08-28 |
| US-2021315896-A1 | Indazole based compounds and associated methods of use | 2020-03-21 |
| WO-2021181122-A1 | Gpr52 modulator compounds | 2020-03-13 |
| WO-2021165245-A1 | Compounds | 2020-02-18 |
