8-Hydroxy-2-quinolinecarboxaldehyde

HCID 599342CAS 14510-06-6

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Grundinformationen

Standard-SMILES: O=Cc1ccc2cccc(O)c2n1
InChIKey: SLBPIHCMXPQAIQ-UHFFFAOYSA-N
Summenformel: C10H7NO2
Durchschnittliche Molmasse: 173,17 g/mol
Monoisotopische Masse: 173,04767846

Überblick

8-hydroxyquinoline-2-carbaldehyde is a hydroxyquinoline.

Namen und Bezeichner

Bevorzugter Name: 8-Hydroxy-2-quinolinecarboxaldehyde
IUPAC: 8-hydroxyquinoline-2-carbaldehyde
Englischer Name: 8-Hydroxyquinoline-2-carboxaldehyde
Summenformel: C10H7NO2
Molmasse: 173.17

Namen und Synonyme

8-Hydroxy-2-quinolinecarboxaldehydeRefChem:548135627-898-28-hydroxyquinoline-2-carbaldehyde14510-06-68-Hydroxyquinoline-2-carboxaldehyde2-Quinolinecarboxaldehyde, 8-hydroxy-MFCD001689628-oxidanylquinoline-2-carbaldehyde2-formyl-8-hydroxyquinoline8-HYDROXY-QUINOLINE-2-CARBALDEHYDEDTXSID20344771

Weitere Namen anzeigen

AKOS BBS-000001288-hydroxyquinaldaldehydeQuinaldaldehyde, 8-hydroxy-8-HYDROXYQUINOLINE-2-CARBOXALDEHYDE 98%8-Hydroxyquinoline-2-carboxaldehyde ,98%

CS-W017556H1713EN300-822178MJ8-Hydroxy-2-quinolinecarbaldehydeA808320Oprea1_030534Oprea1_135969

Datenbank-Bezeichner

CAS: 14510-06-6
PubChem CID: 599342
DTXSID: DTXSID20344771
ChEMBL: CHEMBL2321986
ChEBI: CHEBI:183895
EC Number: 627-898-2
Nikkaji: J102.443D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,6
Polarare Oberfläche (TPSA): 50,2 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 195

Physikochemische Eigenschaften

Schmelzpunkt: 97 · 97-100 °C
Siedepunkt: 392.2 · 392.2±22.0 °C(Predicted)
Dichte: 1.364 · 1.364±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
pka: 9.27 · 9.27±0.10(Predicted)
Aggregatzustand: Crystalline Powder
Farbe: Yellow
BRN: 127519 · 127519
InChI: InChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H
InChIKey: SLBPIHCMXPQAIQ-UHFFFAOYSA-N
SMILES: N1C2C(=CC=CC=2O)C=CC=1C=O
CAS Datenbank: 14510 · 14510-06-6

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk: 3
hs_code: 29339900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36-37/39
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden8-Hydroxy-2-quinolinecarboxaldehyde (8-hydroxyquinoline-2-carbaldehyde) may be used in the preparation of:8-hydroxy-2-quinoline-1-aminopyrene by Schiff-base reaction with 1-aminopyrene(E)-2-((2-(pyridin-2-yl)hydrazono)methyl)quinolin-8-ol by coupling with 2-hydrazinopyridine8-hydroxyquinoline-2-carbaldehyde oxime2-[(8-Hydroxyquinoline)-2-methylaminoethyl]-β-D-glucopyranoside