2-fluoropyridine-4-boronic acid - CAS 401815-98-3
Catalog: |
BB024355 |
Product Name: |
2-fluoropyridine-4-boronic acid |
CAS: |
401815-98-3 |
Synonyms: |
(2-fluoro-4-pyridinyl)boronic acid; (2-fluoropyridin-4-yl)boronic acid |
IUPAC Name: | (2-fluoropyridin-4-yl)boronic acid |
Description: | 2-fluoropyridine-4-boronic acid (CAS# 401815-98-3) is used to synthesize analogues of the antitubercular drug. |
Molecular Weight: | 140.91 |
Molecular Formula: | C5H5BFNO2 |
Canonical 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 |
MDL: | MFCD04112534 |
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 |
CN-113214247-A | Azaindole derivative marrow cell proliferation inhibitor, preparation method and application thereof in pharmacy | 20210114 |
CN-112687878-A | Electrochemical device and electronic device | 20201225 |
US-2021315896-A1 | Indazole based compounds and associated methods of use | 20200321 |
WO-2021181122-A1 | Gpr52 modulator compounds | 20200313 |
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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