3-Fluoro-5-methylpyridine-4-boronic Acid - CAS 1072952-44-3
Catalog: |
BB002043 |
Product Name: |
3-Fluoro-5-methylpyridine-4-boronic Acid |
CAS: |
1072952-44-3 |
Synonyms: |
(3-fluoro-5-methyl-4-pyridinyl)boronic acid; (3-fluoro-5-methylpyridin-4-yl)boronic acid |
IUPAC Name: | (3-fluoro-5-methylpyridin-4-yl)boronic acid |
Description: | 3-Fluoro-5-methylpyridine-4-boronic Acid (CAS# 1072952-44-3) is a useful research chemical. |
Molecular Weight: | 154.93 |
Molecular Formula: | C6H7FNO2B |
Canonical SMILES: | B(C1=C(C=NC=C1C)F)(O)O |
InChI: | InChI=1S/C6H7BFNO2/c1-4-2-9-3-5(8)6(4)7(10)11/h2-3,10-11H,1H3 |
InChI Key: | PEGYCPMGAITWDN-UHFFFAOYSA-N |
LogP: | -0.79110 |
Publication Number | Title | Priority Date |
US-2020308122-A1 | Novel non-systemic tgr5 agonists | 20160701 |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.0553868 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.0553868 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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