6-Fluoropyridine-3-carboxylic acid - CAS 403-45-2
Catalog: |
BB024463 |
Product Name: |
6-Fluoropyridine-3-carboxylic acid |
CAS: |
403-45-2 |
Synonyms: |
6-fluoropyridine-3-carboxylic acid |
IUPAC Name: | 6-fluoropyridine-3-carboxylic acid |
Description: | 6-Fluoropyridine-3-carboxylic acid (CAS# 403-45-2) is a useful research chemical. |
Molecular Weight: | 141.10 |
Molecular Formula: | C6H4FNO2 |
Canonical SMILES: | C1=CC(=NC=C1C(=O)O)F |
InChI: | InChI=1S/C6H4FNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3H,(H,9,10) |
InChI Key: | UJDLCTNVHJEBDG-UHFFFAOYSA-N |
Boiling Point: | 309.4 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.419 g/cm3 |
Appearance: | White to off-white to light yellow crystals or powder |
MDL: | MFCD01859863 |
LogP: | 0.91890 |
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-113501783-A | Erianin heterocyclic derivative and preparation method and application thereof | 20210630 |
CN-113046734-A | Bivalent palladium complex solution and preparation method and application thereof | 20210312 |
CN-112979672-A | 11, 20-dicarbonyl oridonin 14-O esterified series derivatives and application thereof | 20210305 |
CN-112358442-A | Preparation method of 2-fluoro-5-formyl chloropyridine | 20201120 |
CN-112390760-A | FAK-targeting compound and preparation method and application thereof | 20201015 |
PMID | Publication Date | Title | Journal |
20088512 | 20100225 | One step radiosynthesis of 6-[(18)F]fluoronicotinic acid 2,3,5,6-tetrafluorophenyl ester ([(18)F]F-Py-TFP): a new prosthetic group for efficient labeling of biomolecules with fluorine-18 | Journal of medicinal chemistry |
17588745 | 20070901 | Agonist lead identification for the high affinity niacin receptor GPR109a | Bioorganic & medicinal chemistry letters |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.02260653 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.02260653 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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