2,8-Quinolinediol - CAS 15450-76-7
Catalog: |
BB011024 |
Product Name: |
2,8-Quinolinediol |
CAS: |
15450-76-7 |
Synonyms: |
8-hydroxy-1H-quinolin-2-one |
IUPAC Name: | 8-hydroxy-1H-quinolin-2-one |
Description: | 2,8-Quinolinediol (CAS# 15450-76-7) is a substituted quinolinone derivative used in the preparation of pharmaceutical compounds. |
Molecular Weight: | 161.16 |
Molecular Formula: | C9H7NO2 |
Canonical SMILES: | C1=CC2=C(C(=C1)O)NC(=O)C=C2 |
InChI: | InChI=1S/C9H7NO2/c11-7-3-1-2-6-4-5-8(12)10-9(6)7/h1-5,11H,(H,10,12) |
InChI Key: | ZXZKYYHTWHJHFT-UHFFFAOYSA-N |
Boiling Point: | 403.2 °C at 760 mmHg |
Melting Point: | 290 °C (dec.) |
Purity: | 98 % |
Density: | 1.337 g/cm3 |
Appearance: | White to crystalline powder |
MDL: | MFCD00216696 |
LogP: | 1.64600 |
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 |
WO-2021008588-A1 | Class of pyrimidine quinoline derivatives and preparation method therefor and application thereof | 20190716 |
US-2018217085-A1 | Potential gradient amplified detection of chemical agents | 20170127 |
US-10775337-B2 | Potential gradient amplified detection of chemical agents | 20170127 |
EP-3232254-A1 | An optical system for treating chronobiological disorders and/or myopia | 20160411 |
US-2019204624-A1 | Optical system for treating chronobiological disorders and/or myopia | 20160411 |
PMID | Publication Date | Title | Journal |
21666721 | 20120112 | Modulation of Wnt/β-catenin signaling and proliferation by a ferrous iron chelator with therapeutic efficacy in genetically engineered mouse models of cancer | Oncogene |
21398066 | 20110601 | Urinary metabonomics study of anti-depressive effect of Chaihu-Shu-Gan-San on an experimental model of depression induced by chronic variable stress in rats | Journal of pharmaceutical and biomedical analysis |
20554200 | 20101001 | Biodegradation characteristics of quinoline by Pseudomonas putida | Bioresource technology |
20877629 | 20100921 | Interaction of 8-hydroxyquinoline with soil environment mediates its ecological function | PloS one |
19856115 | 20100601 | Quinoline biodegradation and its nitrogen transformation pathway by a Pseudomonas sp. strain | Biodegradation |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.047678466 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.047678466 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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