HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Isopropylthioxanthone
ITX · 4-Isopropylthioxanth · ISOPROPYLTHIOXANTHONE · 4-ISOPROPYLTHIOXANTHONE · 4-Isopropyl-9-thioxanthone · 4-ISOPROPYLTHIOXANTHONE 98+% · 4-isopropylthioxanthen-9-one · 4-Isopropyl-thioxanthene-9-one
Identifikatoren & physikalische Daten
| CAS No. | 83846-86-0 |
|---|---|
| Summenformel | C16H14OS |
| Durchschnittliche Molmasse | 254,3 g/mol |
| Monoisotopische Masse | 254,07653607 g/mol |
| SMILES | CC(C)c1cccc2c(=O)c3ccccc3sc12 |
| InChIKey | IKVYHNPVKUNCJM-UHFFFAOYSA-N |
| PubChem CID | 158403 |
| EC No. | 281-065-4 |
| DTXSID | DTXSID80868761 |
Chemische & physikalische Eigenschaften
| XLogP | 4,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 42,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 18 |
| Formalladung | 0 |
| Komplexität | 325 |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Schmelzpunkt | 107-109°C |
| Siedepunkt | 391.0±32.0 °C(Predicted) |
| Dichte | 1.199±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Refrigerator |
| Löslichkeit | Chloroform (Slightly), Ethyl Acetate (Slightly) |
| Farbe | Pale Yellow |
| Hauptanwendungen | environmental |
| InChI | 1S/C16H14OS/c1-10(2)11-7-5-8-13-15(17)12-6-3-4-9-14(12)18-16(11)13/h3-10H,1-2H3 |
| InChIKey | IKVYHNPVKUNCJM-UHFFFAOYSA-N |
| SMILES | CC(C)c1cccc2C(=O)c3ccccc3Sc12 |
| CAS Datenbank | 83846-86-0(CAS DataBase Reference) |
| EPA chemische Informationen | 9H-Thioxanthen-9-one, 4-(1-methylethyl)- (83846-86-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 64.2% (95 of 148) of all reports.WarningH302 (35.1%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 148 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | 9H-Thioxanthen-9-one, 4-(1-methylethyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Hazard Classes and Categories | Acute Tox. 4 (35.1%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| R-Sätze (R) | 22 |
| Gefahrensymbole | Xn |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Aquatic Acute 1Aquatic Chronic 1Repr. 2 |
Anwendungen & Verwendung
Verwenden
4-Isopropylthioxanthone is a thioxanthone derivative useful as photoinitiators.