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2-Pentylcyclopent-2-en-1-on
AMYL CYCLOPENTENONE · 2-Cyclopenten-1-one, 2-pentyl- · Amylcyclopentenon · 2-Pentyl-2-cyclopentenone · 2-Amyl 2-cyclopenten-1-one · 2-PENTYL-CYCLOPENT-2-ENONE · 2-amylcyclopent-2-en-1-one · 2-PENTYL-2-CYCLOPENEN-1-ONE
Identifikatoren & physikalische Daten
| CAS No. | 25564-22-1 |
|---|---|
| Summenformel | C10H16O |
| Durchschnittliche Molmasse | 152,23 g/mol |
| Monoisotopische Masse | 152,12011513 g/mol |
| SMILES | CCCCCC1=CCCC1=O |
| InChIKey | ILHZVKAXFCDFMT-UHFFFAOYSA-N |
| PubChem CID | 117549 |
| ChEMBL | CHEMBL3183509 |
| EC No. | 247-104-4 |
| DTXSID | DTXSID6029331 |
| Lokaler Name | 2-Pentylcyclopent-2-en-1-on |
Chemische & physikalische Eigenschaften
| XLogP | 3 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 168 |
| Stoffklassen | Other Classes -> Aliphatic Ketones, Other |
| SpringerMaterials Properties | Chemical shift |
| Duftstoffe | Fragrance substance (Amylcyclopentenone) -> IFRA amendment 43 |
| Siedepunkt | 114-116 °C15 mm Hg(lit.) |
| Dichte | 0.921 g/mL at 25 °C(lit.) |
| Dampfdruck | 3.6Pa at 20℃ |
| Brechungsindex | n20/D 1.473(lit.) |
| Flammpunkt | 205 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light orange to Yellow |
| Geruch | at 100.00 %. woody isojasmone jasmin tuberose |
| Geruchsart | floral |
| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
| LogP (Verteilungskoeffizient) | 2.8 |
| CAS Datenbank | 25564-22-1(CAS DataBase Reference) |
| EPA chemische Informationen | 2-Pentyl-2-cyclopenten-1-one (25564-22-1) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH317 (99.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 117 reports by companies from 3 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 2-Cyclopenten-1-one, 2-pentyl-Status: Active Update: 07-03-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/165012-Cyclopenten-1-one, 2-pentyl-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | May cause irritation[Sigma-Aldrich MSDS] See Cyclopentanone. |
| Hazard Classes and Categories | Skin Sens. 1 (99.1%) |
| Wassergefährdungsklasse (WGK) | 2 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2914290090 |
| RTECS-Nr. | GY7310000 |
| Toxizität | LD50 orl-rat: 2200 mg/kg FCTOD7 30,7S,92 |
Anwendungen & Verwendung
Verwenden
Amyl cyclopentenone is suggested for use in perfume compositions, primarily in the creation of artificial Jasmin, Jasmin bases, specialties, etc. It can also be used as a floralizer for fragrances other than those of the Jasmin type, mainly in the milder florals, and in a few sharper ones, such as Hyacinth.