HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Hex-4-en-1-ol
4-hexenol · 4-Hexen-l-ol · Fema no. 3430
Identifikatoren & physikalische Daten
| CAS No. | 6126-50-7 |
|---|---|
| Summenformel | C6H12O |
| Durchschnittliche Molmasse | 100,16 g/mol |
| Monoisotopische Masse | 100,088815 g/mol |
| SMILES | CC=CCCCO |
| InChIKey | VTIODUHBZHNXFP-UHFFFAOYSA-N |
| PubChem CID | 61370 |
| EC No. | 639-129-8 |
| DTXSID | DTXSID30862476 |
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 7 |
| Formalladung | 0 |
| Komplexität | 48,1 |
| Polymers | Other Classes -> Alcohols and Polyols, Other |
| SpringerMaterials Properties | Optical coefficient |
| Duftstoffe | Fragrance Ingredient (4-Hexen-1-ol, (4Z)-) -> IFRA transparency List |
| Lebensmittelzusatzstoffe | FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
| Aromastoffe | EU Flavoring substances |
| Schmelzpunkt | 22.55°C (estimate) |
| Siedepunkt | 152.63°C (estimate) |
| Dichte | 0.8513 |
| Brechungsindex | 1.4402 |
| FEMA | 3430 | 4-HEXEN-1-OL |
| Geruch | at 0.10 % in propylene glycol. pungent green vegetable oily |
| Geruchsart | green |
| JECFA Number | 318 |
| LogP (Verteilungskoeffizient) | 1.54 |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 98.9% (89 of 90) of all reports.Not ClassifiedAggregated GHS information provided per 90 reports by companies from 2 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 4-Hexen-1-ol, (Z)-Chemical: 4-Hexen-1-ol4-Hexen-1-ol: Does not have an individual approval but may be used under an appropriate group standard4-Hexen-1-ol, (4Z)-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | Safe when used as a flavoring agent in food[JECFA] |
| Hazard Classes and Categories | Not Classified |
| Alarmwort | Warnung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H319 |
Anwendungen & Verwendung
Beschreibung
4-Hexen-l-ol has a pungent oily odor. May be synthesized by treating cis- and frans-3-chloro-2-methyl-tetrahydropyrone with sodium in ether.
Occurrence
The cis- and trans-forms occur in banana, the cis-form in passion fruit; also reported in beans, butter and olive
Herstellung & Synthese
synthetische
By treating cis- and trans-3-chloro-2-methyl-tetrahydropyrone with sodium in ether.