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Isononanol
7-Methyloctanol · 7-methyl-1-octano · 7-METHYL-1-OCTANOL · 1-Octanol, 7-methyl- · 7-Methyl-1-octyl Alcohol · 7-Methyloctanol (Isononyl Alcohol) · 7-Methyl-1-octyl Alcohol (unlabelled) · 7-METHYL-1-OCTANOL ISO 9001：2015 REACH
Identifikatoren & physikalische Daten
| CAS No. | 2430-22-0 |
|---|---|
| Summenformel | C9H20O |
| Durchschnittliche Molmasse | 144,25 g/mol |
| Monoisotopische Masse | 144,15141526 g/mol |
| SMILES | CC(C)CCCCCCO |
| InChIKey | QDTDKYHPHANITQ-UHFFFAOYSA-N |
| PubChem CID | 17072 |
| ChEBI | CHEBI:188348 |
| EC No. | 248-471-3 |
| DTXSID | DTXSID2058675 |
Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 59,7 |
| SpringerMaterials Properties | Density |
| Duftstoffe | Fragrance Ingredient (Isononyl alcohol (isomer unspecified)) -> IFRA transparency List |
| Physical Description | Liquid |
| Schmelzpunkt | 64.5°C |
| Siedepunkt | 192.9°C (estimate) |
| Dichte | 0.8260 |
| Brechungsindex | 1.4316 |
| Lagerbedingungen | Refrigerator |
| Löslichkeit | Chloroform, Methanol (Slightly) |
| Aggregatzustand | Oil |
| pKa (Säurekonstante) | 15.20±0.10(Predicted) |
| Farbe | Colourless |
| Henry-Konstante | 4.3×10-2 mol/(m3Pa) at 25℃, Yaws (2003) |
| LogP (Verteilungskoeffizient) | 3.230 (est) |
| EPA chemische Informationen | 1-Octanol, 7-methyl- (2430-22-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 0.2% (1 of 427) of reports.DangerH315 (77.3%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 427 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 1-Octanol, 7-methyl-Chemical: IsononanolIsononanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Isononanol 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)Status: Active Update: 15-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/13404Isononanol: Does not have an individual approval but may be used under an appropriate group standard |
| Weitere Sicherheitsinformationen | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment |
| Hazard Classes and Categories | Skin Irrit. 2 (77.3%) |
Anwendungen & Verwendung
Verwenden
7-METHYL-1-OCTANOL is used in the synthesis of the sex pheromone of Elater ferrugineus.