HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 76913Erstellt: 31. Oktober 2026
Henicosan-11-ol
11-Hecosanol · 1-didecamonol · 11-Henicosanol · 11-HENEICOSANOL · henicosan-11-ol · Di-n-decyl carbinol · 11-Heneicosanol (9CI, ACI)
https://huagongshe.com/de/chemical/76913
Identifikatoren & physikalische Daten
| CAS No. | 3381-26-8 |
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| Summenformel | C21H44O |
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| Durchschnittliche Molmasse | 312,6 g/mol |
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| Monoisotopische Masse | 312,33921602 g/mol |
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| SMILES | CCCCCCCCCCC(O)CCCCCCCCCC |
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| InChIKey | BCNCKKYOXRHQGT-UHFFFAOYSA-N |
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| PubChem CID | 76913 |
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| ChEBI | CHEBI:197501 |
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| EC No. | 222-184-3 |
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| DTXSID | DTXSID90187470 |
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| Lokaler Name | Henicosan-11-ol |
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Chemische & physikalische Eigenschaften
| XLogP | 9,7 |
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| Polarare Oberfläche (TPSA) | 20,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 18 |
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| Schwere Atome | 22 |
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| Formalladung | 0 |
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| Komplexität | 170 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 71-72°C |
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| Siedepunkt | 370.3±10.0 °C(Predicted) |
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| Dichte | 0.837±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 15.23±0.20(Predicted) |
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| Aggregatzustand | Solid |
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| Farbe | White to off-white |
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| BRN | 1765841 |
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| InChI | InChI=1S/C21H44O/c1-3-5-7-9-11-13-15-17-19-21(22)20-18-16-14-12-10-8-6-4-2/h21-22H,3-20H2,1-2H3 |
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| InChIKey | BCNCKKYOXRHQGT-UHFFFAOYSA-N |
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| SMILES | CCCCCCCCCCC(O)CCCCCCCCCC |
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| LogP (Verteilungskoeffizient) | 9.344 (est) |
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| CAS Datenbank | 3381-26-8 |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 2.5% (1 of 40) of reports.WarningH319 (97.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Eye Irrit. 2 (97.5%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H319 |
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