Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 1474501Erstellt: 26. Oktober 2026

Sertraline ketone

DASO-005 · Sertraline Tetralone (S)-IsoMer · Sertraline EP Impurity F Enantiomer · (S)-4-(3,4-Dichlorophenyl)-1-tetralon · (S)-4-(3,4-Dichlorophenyl)-1-tetralone · (4S)-4-(3,4-dichlorophenyl)-1-tetralone · 4-(3,4-DICHLOROPHENYL)-3,4-DIHYDRO-1(2H)-NAPHTHALENONE · 4-(3,4-DICHLOROPHENYL)-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE

https://huagongshe.com/de/chemical/1474501

Molekülstruktur von Sertraline ketone

Identifikatoren & physikalische Daten

CAS No.124379-29-9
SummenformelC16H12Cl2O
Durchschnittliche Molmasse291,2 g/mol
Monoisotopische Masse290,0265204 g/mol
SMILESO=C1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21
InChIKeyJGMBHJNMQVKDMW-NSHDSACASA-N
PubChem CID1474501
EC No.444-830-5
DTXSIDDTXSID40924791

Chemische & physikalische Eigenschaften

XLogP4,7
Polarare Oberfläche (TPSA)17,1
H-Brücken-Donoren0
H-Brücken-Akzeptoren1
Frei drehbare Bindungen1
Schwere Atome19
Formalladung0
Komplexität344
Kovats Retention Index2480
Schmelzpunkt840C
Siedepunkt403.0±45.0 °C(Predicted)
Dichte1.318±0.06 g/cm3(Predicted)
LagerbedingungenRefrigerator
LöslichkeitBenzene (Slightly), Chloroform (Slightly), Dichloromethane, Methanol (Slightly)
AggregatzustandSolid
FarbeDark Yellow

Sicherheit & Vorschriften

GHS-EinstufungH413: May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]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.
Regulatorische InformationenStatus: Active Update: 31-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/30635
Hazard Classes and CategoriesAquatic Chronic 4 (100%)Hazardous to the aquatic environment (chronic) - category 4Aquatic Chronic 4
GefahrenhinweiseCode Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H413