5-(4-Fluorophenyl)furan-2-carboxylic Acid - CAS 73269-32-6
Catalog: |
BB034810 |
Product Name: |
5-(4-Fluorophenyl)furan-2-carboxylic Acid |
CAS: |
73269-32-6 |
Synonyms: |
5-(4-fluorophenyl)-2-furancarboxylic acid; 5-(4-fluorophenyl)furan-2-carboxylic acid |
IUPAC Name: | 5-(4-fluorophenyl)furan-2-carboxylic acid |
Description: | 5-(4-Fluorophenyl)furan-2-carboxylic Acid has been used in the receptor structure-based discovery of non-metabolite agonists for succinate receptor gpr91. |
Molecular Weight: | 206.17 |
Molecular Formula: | C11H7FO3 |
Canonical SMILES: | C1=CC(=CC=C1C2=CC=C(O2)C(=O)O)F |
InChI: | InChI=1S/C11H7FO3/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H,13,14) |
InChI Key: | CEPXYOAURAQQGM-UHFFFAOYSA-N |
Boiling Point: | 364.1 °C at 760 mmHg |
Density: | 1.336 g/cm3 |
Appearance: | Solid |
MDL: | MFCD02104577 |
LogP: | 2.78390 |
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-111499628-A | 2-furoylamide compound and preparation and application thereof | 20200327 |
KR-101897797-B1 | Cyclic amino substituted 5-arylfuran-2-carboxamide, preparation method thereof, and pharmaceutical composition for use in preventing or treating Urotensin-â…¡ receptor activity related diseases containing the same as an active ingredient | 20170421 |
AU-2006281497-A1 | Piperidine and piperazine derivatives as P2X3 antagonists | 20050815 |
AU-2006281497-B2 | Piperidine and piperazine derivatives as P2X3 antagonists | 20050815 |
BR-PI0614577-A2 | piperidine and piperazine derivatives as p2x3 antagonists | 20050815 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.03792224 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.03792224 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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