3-Fluoropyridine-4-boronic Acid
Product Information
Molecular Formula
C5H5FNO2B
Molecular Weight
140.91
Description
3-Fluoropyridine-4-boronic Acid (CAS# 458532-97-3) is a useful research chemical.
Synonyms
(3-fluoro-4-pyridinyl)boronic acid; (3-fluoropyridin-4-yl)boronic acid
IUPAC Name
(3-fluoropyridin-4-yl)boronic acid
SMILES
B(C1=C(C=NC=C1)F)(O)O
InChI
InChI=1S/C5H5BFNO2/c7-5-3-8-2-1-4(5)6(9)10/h1-3,9-10H
InChI Key
QUHSESYLMZVXCN-UHFFFAOYSA-N
Boiling Point
268.9 °C at 760 mmHg
Flash Point
Not applicable
Density
1.14 g/cm3
LogP
-1.09950
Safety Information
Hazards
H315 - H319 - H335
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-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 |
| WO-2022048684-A1 | Jnk inhibitor, pharmaceutical composition thereof and use thereof | 2020-09-07 |
| WO-2021150574-A1 | Sulfonimidamide compounds as nlrp3 modulators | 2020-01-22 |
| WO-2021130732-A1 | Antibacterial quinolines | 2019-12-27 |
| WO-2021113263-A1 | Crf receptor antagonists and methods of use | 2019-12-04 |
| WO-2020231739-A2 | Compounds and methods for treating cancer | 2019-05-10 |
| EP-3966208-A2 | Compounds and methods for treating cancer | 2019-05-10 |
| WO-2020221239-A1 | Oxaazaquinazoline-7(8h)-ketone compound, preparation method therfor and pharmaceutical application thereof | 2019-04-28 |
| CN-113767106-A | Oxaazaquinazolin-7 (8H) -ones, their preparation and pharmaceutical use | 2019-04-28 |
