HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 62349Erstellt: 31. Oktober 2026
7-Isopropyl-4-methyloxepan-2-on
7-Isopropyl-4-methyloxepan-2-on · 7-isopropyl-4-methyloxepan-2-one · 4-methyl-7-propan-2-yloxepan-2-one · 4-methyl-7-propan-2-yl-oxepan-2-one · 2-Oxepanone, 4-methyl-7-(1-methylethyl)- · 7-isopropyl-4-methyloxepan-2-one USP/EP/BP
https://huagongshe.com/de/chemical/62349
Identifikatoren & physikalische Daten
| CAS No. | 499-54-7 |
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| Summenformel | C10H18O2 |
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| Durchschnittliche Molmasse | 170,25 g/mol |
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| Monoisotopische Masse | 170,13067981 g/mol |
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| SMILES | CC1CCC(C(C)C)OC(=O)C1 |
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| InChIKey | GGAXPLCKKANQED-UHFFFAOYSA-N |
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| PubChem CID | 62349 |
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| ChEBI | CHEBI:50243 |
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| EC No. | 207-882-8 |
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| DTXSID | DTXSID70862051 |
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| Lokaler Name | 7-Isopropyl-4-methyloxepan-2-on |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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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 | 1 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 163 |
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| Lebensmittelzusatzstoffe | FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
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| Dichte | 0.966-0.9730.926±0.06 g/cm3(Predicted) |
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| Aromastoffe | EU Flavoring substances |
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| Löslichkeit | very soluble in water and soluble in alcohol(in ethanol) |
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| Siedepunkt | 247.00 to 248.00 °C. @ 760.00 mm Hg248.3±8.0 °C(Predicted) |
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| Brechungsindex | 1.457-1.461 |
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| Physical Description | colourless, low-melting solid with a maple syrup or brown sugar odour |
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| FEMA | 3355 | 6-HYDROXY-3,7-DIMETHYLOCTANOIC ACID LACTONE |
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| Geruch | at 1.00 % in propylene glycol. maple syrup brown sugar |
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| Geruchsart | caramellic |
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| JECFA Number | 237 |
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| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
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| LogP (Verteilungskoeffizient) | 2.23 |
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| EPA chemische Informationen | 2-Oxepanone, 4-methyl-7-(1-methylethyl)- (499-54-7) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.Not ClassifiedAggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Chemical: 2-Oxepanone, 4-methyl-7-(1-methylethyl)-2-Oxepanone, 4-methyl-7-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard |
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| Weitere Sicherheitsinformationen | IMAP assessments - 2-Oxepanone, 4-methyl-7-(1-methylethyl)-: Human health tier I assessment |
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| Hazard Classes and Categories | Not Classified |
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| TSCA-Inventar-Status | TSCA listed |
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