HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Hexyldecan-1-ol
1-Decanol, 2-hexyl- · 2-Hexyl-decan-1-ol · Isofol 16 · 2-hexyl-1-decano · EA489 · 2-HexyL · C610-OH · NSC 2399
Identifikatoren & physikalische Daten
| CAS No. | 2425-77-6 |
|---|---|
| Summenformel | C16H34O |
| Durchschnittliche Molmasse | 242,44 g/mol |
| Monoisotopische Masse | 242,26096571 g/mol |
| SMILES | CCCCCCCCC(CO)CCCCCC |
| InChIKey | XULHFMYCBKQGEE-UHFFFAOYSA-N |
| PubChem CID | 95337 |
| ChEMBL | CHEMBL3560208 |
| ChEBI | CHEBI:183266 |
| EC No. | 219-370-1 |
| DTXSID | DTXSID1041265 |
| Lokaler Name | 2-Hexyldecan-1-ol |
Chemische & physikalische Eigenschaften
| XLogP | 7 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 13 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 133 |
| Polymers | Other Classes -> Alcohols and Polyols, Other |
| Kosmetika | Skin conditioningHumectantSolvent |
| Duftstoffe | Fragrance Ingredient (1-_Decanol, 2-_hexyl-) -> IFRA transparency List |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Physical Description | LiquidColorless oily liquid with a mild sweet odor[Sasol MSDS] |
| Schmelzpunkt | -21--15 °C (lit.) |
| Siedepunkt | 193-197 °C/33 mmHg (lit.) |
| Dichte | 0.836 g/mL at 25 °C (lit.) |
| Dampfdruck | 0.4Pa at 148.85℃ |
| Brechungsindex | n20/D 1.449(lit.) |
| Flammpunkt | 113 °C |
| Lagerbedingungen | Refrigerator |
| Löslichkeit | Benzene (Sparingly), Chloroform (Sparingly), Methanol (Slightly) |
| pKa (Säurekonstante) | 15.08±0.10(Predicted) |
| Aggregatzustand | Oil |
| Farbe | Clear Colourless |
| Kosmetik-Inhaltsstoffe Funktionen | SKIN CONDITIONINGSKIN CONDITIONING - EMOLLIENT |
| InChI | 1S/C16H34O/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3 |
| InChIKey | XULHFMYCBKQGEE-UHFFFAOYSA-N |
| SMILES | CCCCCCCCC(CO)CCCCCC |
| LogP (Verteilungskoeffizient) | 6.66 at 20℃ |
| NIST chemische Informationen | 1-Decanol, 2-hexyl-(2425-77-6) |
| EPA chemische Informationen | 1-Decanol, 2-hexyl- (2425-77-6) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 99.4% (351 of 353) of all reports.Not ClassifiedAggregated GHS information provided per 353 reports by companies from 4 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 1-Decanol, 2-hexyl-1-Decanol, 2-hexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Decanol, 2-hexyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.Status: Active Update: 08-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/55851-Decanol, 2-hexyl-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | An eye, nose, and throat irritantInhalation may cause dizziness and headache[Sasol MSDS] |
| Hazard Classes and Categories | Not Classified |
| Wassergefährdungsklasse (WGK) | nwg |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2905.19.9090 |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
2-Hexyl-1-decanol may be employed as an organic solvent to study the extraction of non-polar acidic drugs from human plasma by parallel artificial liquid membrane extraction (PALME).