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HCID 95421Erstellt: 26. Oktober 2026
Octadecan-1,12-diol
Loxanol · Alfol A · NSC 8551 · Sovermol 912 · 12-HYDROXY STEARYL · 1,12-Octadecandiol · 1,12-Octadecanediol · octadecane-1,12-diol
https://huagongshe.com/de/chemical/95421
Identifikatoren & physikalische Daten
| CAS No. | 2726-73-0 |
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| Summenformel | C18H38O2 |
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| Durchschnittliche Molmasse | 286,5 g/mol |
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| Monoisotopische Masse | 286,28718046 g/mol |
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| SMILES | CCCCCCC(O)CCCCCCCCCCCO |
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| InChIKey | KHLCTMQBMINUNT-UHFFFAOYSA-N |
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| PubChem CID | 95421 |
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| EC No. | 220-342-6 |
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| DTXSID | DTXSID401036200 |
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| Lokaler Name | Octadecan-1,12-diol |
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Chemische & physikalische Eigenschaften
| XLogP | 7 |
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| Polarare Oberfläche (TPSA) | 40,5 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 16 |
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| Schwere Atome | 20 |
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| Formalladung | 0 |
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| Komplexität | 171 |
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| Schmelzpunkt | 79.5-80℃ |
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| Siedepunkt | 180-182 °C(Press: 0.5 Torr) |
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| Dichte | 0.892±0.06 g/cm3(Predicted) |
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| Dampfdruck | 0Pa at 20℃ |
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| pKa (Säurekonstante) | 15.20±0.10(Predicted) |
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| Löslichkeit | 35.01μg/L at 20℃ |
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| Kosmetik-Inhaltsstoffe Funktionen | SURFACTANT - EMULSIFYING |
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| InChI | 1S/C18H38O2/c1-2-3-4-12-15-18(20)16-13-10-8-6-5-7-9-11-14-17-19/h18-20H,2-17H2,1H3 |
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| InChIKey | KHLCTMQBMINUNT-UHFFFAOYSA-N |
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| SMILES | CCCCCCC(O)CCCCCCCCCCCO |
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| LogP (Verteilungskoeffizient) | 6.58 at 25℃ |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (25 of 25) of all reports.Not ClassifiedAggregated GHS information provided per 25 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Chemical: 1,12-OctadecanediolStatus: Active Update: 08-06-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/174791,12-Octadecanediol: Does not have an individual approval but may be used under an appropriate group standard |
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| Weitere Sicherheitsinformationen | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health |
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| Hazard Classes and Categories | Not Classified |
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| Wassergefährdungsklasse (WGK) | - |
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| Lagerklasse | 11 - Combustible Solids |
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