5-Fluoropyridine-3-carboxylic acid - CAS 402-66-4
Catalog: |
BB024408 |
Product Name: |
5-Fluoropyridine-3-carboxylic acid |
CAS: |
402-66-4 |
Synonyms: |
5-fluoropyridine-3-carboxylic acid |
IUPAC Name: | 5-fluoropyridine-3-carboxylic acid |
Description: | 5-Fluoropyridine-3-carboxylic acid (CAS# 402-66-4) is a useful research chemical. |
Molecular Weight: | 141.10 |
Molecular Formula: | C6H4FNO2 |
Canonical SMILES: | C1=C(C=NC=C1F)C(=O)O |
InChI: | InChI=1S/C6H4FNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10) |
InChI Key: | BXZSBDDOYIWMGC-UHFFFAOYSA-N |
Boiling Point: | 272.2 °C at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.419 g/cm3 |
MDL: | MFCD01318537 |
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-112979672-A | 11, 20-dicarbonyl oridonin 14-O esterified series derivatives and application thereof | 20210305 |
WO-2021139595-A1 | RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 20200106 |
WO-2021139599-A1 | RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 20200106 |
CN-111162313-A | Polymer electrolyte and lithium ion battery | 20191223 |
PMID | Publication Date | Title | Journal |
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: | 0.5 |
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