1-Phenyloxindole (HCID 314787)

Namen und Bezeichner

Bevorzugter Name: 1-Phenyloxindole
IUPAC: 1-phenyl-3H-indol-2-one
Englischer Name: 1-Phenyloxindole
Summenformel: C14H11NO
Molmasse: 209.24

Namen und Synonyme

1-Phenyloxindole3335-98-61-phenyl-1,3-dihydro-2H-indol-2-one1-phenyl-3H-indol-2-onen-phenyloxindole1-Phenyl-2-indolinone1,3-DIHYDRO-1-PHENYL-2H-INDOL-2-ONEOxindole, 1-phenyl-n-phenyl-2-indolinoneN-Phenylindolin-2-one2H-Indol-2-one, 1,3-dihydro-1-phenyl-2-Indolinone, 1-phenyl-

Weitere Namen anzeigen

1-PHENYLINDOLIN-2-ONEPhenyloxindolPHENYLOXINDOLEN-phenylindoleone1-PHENYLLOX INDOLE1-phenoxy-1H-indole1-Phenyloxindole>1-Phenyl-2-indolinone

1-phenyl-1,3-dihydro-indol-2-one2FQG528CES1-Phenyl-1H-indolin-2-oneNSC-234518DTXSID50310944RefChem:435725DTXCID50262070441-020-3

Datenbank-Bezeichner

CAS: 3335-98-6
PubChem CID: 314787
DTXSID: DTXSID50310944
ChEMBL: CHEMBL1305587
UNII: 2FQG528CES
EC Number: 441-020-3、608-864-6
Nikkaji: J620.555K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,5
Polarare Oberfläche (TPSA): 20,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 16
Formalladung: 0
Komplexität: 270

Physikochemische Eigenschaften

Schmelzpunkt: 123 · 123-125
Siedepunkt: 443.6 · 443.6±25.0 °C(Predicted)
Dichte: 1.228 · 1.228±0.06 g/cm3(Predicted)
Dampfdruck: 0.002 Pa · 0.002Pa at 20℃
storage temp.: Sealed in dry,Room Temperature
Löslichkeit: Practically insoluble in water
Aggregatzustand: powder to crystal
pka: -3.41 · -3.41±0.20(Predicted)
Farbe: White to Light yellow
Wasserlöslichkeit: 74.3 mg/L · 74.3mg/L at 20℃
InChI: InChI=1S/C14H11NO/c16-14-10-11-6-4-5-9-13(11)15(14)12-7-2-1-3-8-12/h1-9H,10H2
InChIKey: OWPNVXATCSXTBK-UHFFFAOYSA-N
SMILES: N1(C2=CC=CC=C2)C2=C(C=CC=C2)CC1=O
LogP: 2.6 at · 2.6 at 26℃
CAS Datenbank: 3335 · 3335-98-6(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.；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.

H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Gefahrenhinweise

Regulatory InformationStatus: Active Update: 24-09-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/13006；Status: Active Update: 10-02-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/19230

Hazard Classes and CategoriesAquatic Chronic 2 (100%)

Regulatorische Informationen

Regulatory InformationStatus: Active Update: 24-09-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/13006；Status: Active Update: 10-02-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/19230