HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 94608Erstellt: 24. Oktober 2026
1-Cyclohexylethylbutyrat
CP80624 · Einecs 264-158-4 · CYCLOHEXYLETHYL BUTYRATE · 1-CYCLOHEXYLETHYLBUTANOATE · 1-cyclohexylethyl butyrate · 1-cyclohexylethan-1-yl butyrate · 1-cyclohexylethylbutyric acidester · Butyric acid 1-cyclohexylethyl ester
https://huagongshe.com/de/chemical/94608
Identifikatoren & physikalische Daten
| CAS No. | 63449-88-7 |
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| Summenformel | C12H22O2 |
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| Durchschnittliche Molmasse | 198,3 g/mol |
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| Monoisotopische Masse | 198,16197994 g/mol |
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| SMILES | CCCC(=O)OC(C)C1CCCCC1 |
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| InChIKey | FTMSYMOBBRINAR-UHFFFAOYSA-N |
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| PubChem CID | 94608 |
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| EC No. | 264-158-4 |
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| DTXSID | DTXSID2052316 |
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| Lokaler Name | 1-Cyclohexylethylbutyrat |
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Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
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| Polarare Oberfläche (TPSA) | 26,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 171 |
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| Duftstoffe | Fragrance Ingredient (1-Cyclohexylethyl butyrate) -> IFRA transparency List |
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| Siedepunkt | 246.5℃[at 101 325 Pa] |
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| Dichte | 0.928[at 20℃] |
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| Dampfdruck | 6.5Pa at 24℃ |
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| Löslichkeit | 23.8mg/L at 24℃ |
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| Kosmetik-Inhaltsstoffe Funktionen | FRAGRANCE |
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| LogP (Verteilungskoeffizient) | 5.2 at 20℃ |
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| EPA chemische Informationen | Butanoic acid, 1-cyclohexylethyl ester (63449-88-7) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (94.9%): 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 236 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: Butanoic acid, 1-cyclohexylethyl esterStatus: Active Update: 19-04-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19640 |
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| Hazard Classes and Categories | Skin Irrit. 2 (94.9%) |
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| TSCA-Inventar-Status | TSCA listed |
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