3-Formylchromone - CAS 17422-74-1
Catalog: |
BB012997 |
Product Name: |
3-Formylchromone |
CAS: |
17422-74-1 |
Synonyms: |
4-oxochromene-3-carbaldehyde |
IUPAC Name: | 4-oxochromene-3-carbaldehyde |
Description: | 3-Formylchromone (CAS# 17422-74-1) is a useful research chemical. |
Molecular Weight: | 174.15 |
Molecular Formula: | C10H6O3 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=O)C(=CO2)C=O |
InChI: | InChI=1S/C10H6O3/c11-5-7-6-13-9-4-2-1-3-8(9)10(7)12/h1-6H |
InChI Key: | FSMYWBQIMDSGQP-UHFFFAOYSA-N |
Boiling Point: | 303.1 °C at 760 mmHg |
Density: | 1.431 g/cm3 |
MDL: | MFCD00014667 |
LogP: | 1.60550 |
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PMID | Publication Date | Title | Journal |
24954034 | 20140805 | Formylchromone exhibits salubrious effects against nitrosodiethylamine mediated early hepatocellular carcinogenesis in rats | Chemico-biological interactions |
21985426 | 20121001 | Chromone containing sulfonamides as potent carbonic anhydrase inhibitors | Journal of enzyme inhibition and medicinal chemistry |
22850212 | 20120901 | Selected chromone derivatives as inhibitors of monoamine oxidase | Bioorganic & medicinal chemistry letters |
21612378 | 20120201 | Thermal solvent-free synthesis of chromonyl chalcones, pyrazolines and their in vitro antibacterial, antifungal activities | Journal of enzyme inhibition and medicinal chemistry |
22065587 | 20120102 | 3-Formylchromone interacts with cysteine 38 in p65 protein and with cysteine 179 in IκBα kinase, leading to down-regulation of nuclear factor-κB (NF-κB)-regulated gene products and sensitization of tumor cells | The Journal of biological chemistry |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.031694049 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.031694049 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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