3-Fluoropyridine-4-boronic Acid - CAS 458532-97-3
Catalog: |
BB026002 |
Product Name: |
3-Fluoropyridine-4-boronic Acid |
CAS: |
458532-97-3 |
Synonyms: |
(3-fluoro-4-pyridinyl)boronic acid; (3-fluoropyridin-4-yl)boronic acid |
IUPAC Name: | (3-fluoropyridin-4-yl)boronic acid |
Description: | 3-Fluoropyridine-4-boronic Acid (CAS# 458532-97-3) is a useful research chemical. |
Molecular Weight: | 140.91 |
Molecular Formula: | C5H5FNO2B |
Canonical 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 |
MDL: | MFCD03788558 |
LogP: | -1.09950 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
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 |
Publication Number | Title | Priority Date |
CN-113461666-A | Biphenyl diaryl methyl pyrimidine derivative containing aromatic heterocyclic structure and preparation method thereof | 20210506 |
WO-2021150574-A1 | Sulfonimidamide compounds as nlrp3 modulators | 20200122 |
WO-2021130732-A1 | Antibacterial quinolines | 20191227 |
WO-2021113263-A1 | Crf receptor antagonists and methods of use | 20191204 |
WO-2020231739-A2 | Compounds and methods for treating cancer | 20190510 |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.0397367 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.0397367 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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