3-Quinolinecarboxaldehyde - CAS 13669-42-6
Catalog: |
BB008396 |
Product Name: |
3-Quinolinecarboxaldehyde |
CAS: |
13669-42-6 |
Synonyms: |
quinoline-3-carbaldehyde |
IUPAC Name: | quinoline-3-carbaldehyde |
Description: | 3-Quinolinecarboxaldehyde (CAS# 13669-42-6) is a useful research chemical. |
Molecular Weight: | 157.17 |
Molecular Formula: | C10H7NO |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(C=N2)C=O |
InChI: | InChI=1S/C10H7NO/c12-7-8-5-9-3-1-2-4-10(9)11-6-8/h1-7H |
InChI Key: | RYGIHSLRMNXWCN-UHFFFAOYSA-N |
Boiling Point: | 314.3 °C at 760 mmHg |
Melting Point: | 68-71 °C |
Purity: | > 95.0 % (GC) (T) |
Density: | 1.223 g/cm3 |
Appearance: | White to yellow powder |
Storage: | 2-8 °C |
MDL: | MFCD00006768 |
LogP: | 2.04730 |
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-113501817-A | Quinolinone derivative containing arylamine group and preparation and application thereof | 20210708 |
CN-112961177-A | Near-infrared fluorescent probe for detecting reduced nicotinamide adenine dinucleotide NADH and preparation method and application thereof | 20210308 |
CN-112479998-A | Dihydroquinoline fluorescent probe and preparation method and application thereof | 20201116 |
CN-112250629-A | Surfactant type corrosion inhibitor and preparation method thereof | 20201016 |
CN-111518166-A | Peptide-like compound or pharmaceutically acceptable salt thereof, and preparation method and application thereof | 20200520 |
PMID | Publication Date | Title | Journal |
23414843 | 20130315 | An efficient domino reaction in ionic liquid: synthesis and biological evaluation of some pyrano- and thiopyrano-fused heterocycles | Bioorganic & medicinal chemistry letters |
22306447 | 20120501 | Theoretical and experimental studies on the vibrational spectra of 3-quinolinecarboxaldehyde | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
20652226 | 20100801 | Determination of Imazaquin and its metabolite by liquid chromatography-quadrupole-time of flight tandem mass | Bulletin of environmental contamination and toxicology |
15664867 | 20050201 | Identification of agonists and antagonists of the human melanocortin-4 receptor from piperazinebenzylamines | Bioorganic & medicinal chemistry letters |
11828439 | 20010202 | Application of 3-quinolinoyl picket porphyrins to the electroreduction of dioxygen to water: mimicking the active site of cytochrome c oxidase | Chembiochem : a European journal of chemical biology |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.052763847 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.052763847 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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