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HCID 85576Erstellt: 1. November 2026
3-Octoxypropanenitrile
Einecs 240-789-0 · 3-Octoxypropanenitrile · 2-Cyanoethyloctyl ether · 3-(octyloxy)propiononitrile · Propanenitrile, 3-(octyloxy)-
https://huagongshe.com/de/chemical/85576
Identifikatoren & physikalische Daten
| CAS No. | 16728-49-7 |
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| Summenformel | C11H21NO |
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| Durchschnittliche Molmasse | 183,29 g/mol |
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| Monoisotopische Masse | 183,16231429 g/mol |
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| SMILES | CCCCCCCCOCCC#N |
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| InChIKey | JUBCYGQFVNMTIM-UHFFFAOYSA-N |
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| PubChem CID | 85576 |
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| ChEMBL | CHEMBL3181931 |
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| EC No. | 240-789-0 |
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| DTXSID | DTXSID8044599 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,2 |
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| Polarare Oberfläche (TPSA) | 33 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 9 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 136 |
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| Physical Description | Liquid |
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| EPA chemische Informationen | 3-(Octyloxy)propionitrile (16728-49-7) |
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Sicherheit & Vorschriften
| Regulatorische Informationen | Propanenitrile, 3-(octyloxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanenitrile, 3-(octyloxy)- 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) |
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| TSCA-Inventar-Status | TSCA listed |
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