HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 8090Erstellt: 26. Oktober 2026
Butylpalmitat
BUTYL PALMITATE · Butylpalmittate · N-BUTYL PALMITATE · ButylPalmitate>Palmitic acid butyl · PALMITIC ACID N-BUTY · n-Butyl hexadecanoate · Dronedarone Impurity 53 · hexadecanoicacidbutylester
https://huagongshe.com/de/chemical/8090
Identifikatoren & physikalische Daten
| CAS No. | 111-06-8 |
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| Summenformel | C20H40O2 |
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| Durchschnittliche Molmasse | 312,5 g/mol |
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| Monoisotopische Masse | 312,30283052 g/mol |
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| SMILES | CCCCCCCCCCCCCCCC(=O)OCCCC |
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| InChIKey | GLYJVQDYLFAUFC-UHFFFAOYSA-N |
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| PubChem CID | 8090 |
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| ChEBI | CHEBI:132549 |
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| EC No. | 203-829-8 |
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| DTXSID | DTXSID3059395 |
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| Lokaler Name | Butylpalmitat |
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Chemische & physikalische Eigenschaften
| XLogP | 8,7 |
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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 | 18 |
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| Schwere Atome | 22 |
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| Formalladung | 0 |
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| Komplexität | 226 |
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| Stoffklassen | Other Classes -> Esters, Other |
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| Aromastoffe | EU Flavoring substances |
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| Dampfdruck | 0.0000172 [mmHg] |
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| Food Contact Substances | FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR |
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| Physical Description | Light yellow liquid or solid with a pleasant fruity odormp = 17 deg C[Chem Service MSDS] |
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| Schmelzpunkt | 16.9°C |
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| Siedepunkt | 170 °C / 10mmHg |
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| Dichte | 0.86 |
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| Brechungsindex | 1.4400 to 1.4440 |
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| Flammpunkt | 14 °C |
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| Lagerbedingungen | 2-8°C |
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| Aggregatzustand | clear liquid |
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| Farbe | Colorless to Light yellow to Light orange |
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| Hauptanwendungen | pharmaceutical (small molecule) |
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| Kosmetik-Inhaltsstoffe Funktionen | SKIN CONDITIONING - EMOLLIENT |
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| InChI | 1S/C20H40O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19-6-4-2/h3-19H2,1-2H3 |
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| InChIKey | GLYJVQDYLFAUFC-UHFFFAOYSA-N |
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| SMILES | O(CCCC)C(=O)CCCCCCCCCCCCCCC |
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| LogP (Verteilungskoeffizient) | 8.937 (est) |
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| CAS Datenbank | 111-06-8(CAS DataBase Reference) |
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| EPA chemische Informationen | Hexadecanoic acid, butyl ester (111-06-8) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.Not ClassifiedAggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Chemical: Hexadecanoic acid, butyl esterCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)Hexadecanoic acid, butyl ester: 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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| Gefahrenübersicht | May cause irritation[Chem Service MSDS] |
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| Hazard Classes and Categories | Not Classified |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 2915700100 |
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| Lagerklasse | 11 - Combustible Solids |
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