CAS 68527-66-2 6-Chloro-8-nitroquinoline (HCID 110462)

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Grundinformationen

CAS: 68527-66-2
Standard-SMILES: O=[N+]([O-])c1cc(Cl)cc2cccnc12
InChIKey: LLXHVCBOOWNXPV-UHFFFAOYSA-N
Summenformel: C9H5ClN2O2
Durchschnittliche Molmasse: 208,6 g/mol
Monoisotopische Masse: 208,0039551

Namen und Bezeichner

Bevorzugter Name: 6-Chloro-8-nitroquinoline
IUPAC: 6-chloro-8-nitroquinoline
Englischer Name: 6-chloro-8-nitroquinoline
Summenformel: C9H5ClN2O2
Molmasse: 208.6

Namen und Synonyme

6-Chloro-8-nitroquinolineQuinoline, 6-chloro-8-nitro-DTXSID2071609RefChem:104417DTXCID4046078659-368-168527-66-2MFCD000923806-CHLORO-8-NITRO-QUINOLINESCHEMBL3557626SMSSF-0510063AKOS000127237

Weitere Namen anzeigen

CS-W015198MB00632AMS_CNC_ID-1069463980NCGC00331616-01AS-48698SY172893DB-074037EN300-29787

Datenbank-Bezeichner

CAS: 68527-66-2
PubChem CID: 110462
DTXSID: DTXSID2071609
EC Number: 659-368-1
Nikkaji: J441.183H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,5
Polarare Oberfläche (TPSA): 58,7 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 14
Formalladung: 0
Komplexität: 231

Physikochemische Eigenschaften

Schmelzpunkt: 159 °C · 159 °C
Siedepunkt: 343.8 · 343.8±27.0 °C(Predicted)
Dichte: 1.484 · 1.484±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 0.41 · 0.41±0.20(Predicted)
EPA chemische Informationen: 6 · 6-Chloro-8-nitroquinoline (68527-66-2)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.