HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 175606Erstellt: 1. November 2026
S-[1-Methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] ethanethioate
https://huagongshe.com/de/chemical/175606
Identifikatoren & physikalische Daten
| CAS No. | 94293-57-9 |
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| Summenformel | C12H20O2S |
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| Durchschnittliche Molmasse | 228,35 g/mol |
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| Monoisotopische Masse | 228,11840105 g/mol |
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| SMILES | CC(=S)OC(C)(C)[C@@H]1CCC(C)CC1=O |
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| InChIKey | ICHFAYSVCHABJK-LHIURRSHSA-N |
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| PubChem CID | 175606 |
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| EC No. | 304-949-4 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,5 |
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| Polarare Oberfläche (TPSA) | 58,4 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 271 |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 10.4% (12 of 115) of reports.WarningH315 (89.6%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)Aggregated GHS information provided per 115 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Ethanethioic acid, S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] ester |
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| Hazard Classes and Categories | Skin Irrit. 2 (89.6%) |
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![Molekülstruktur von S-[1-Methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] ethanethioate](/img/chemical/175606.png)