Grundinformationen
- Standard-SMILES
CCCC=CC(=O)OC- InChIKey
GFUGBRNILVVWIE-UHFFFAOYSA-N- Summenformel
- C7H12O2
- Durchschnittliche Molmasse
- 128,17 g/mol
- Monoisotopische Masse
- 128,08372962
Überblick
Methyl 2-hexenoate has been reported in Annona muricata and Carica papaya with data available.
Namen und Bezeichner
- Bevorzugter Name
- Methyl 2-hexenoate
- IUPAC
- methyl hex-2-enoate
Namen und Synonyme
methyl hex-2-enoate2-Hexenoic acid, methyl ester2396-77-2Methyl beta-propylacrylateUNII-Q6M9281R5YFEMA No. 2709AI3-36590DTXSID2062375Q6M9281R5YMethyl hex-2-enoic acidRefChem:157339DTXCID5036975
Weitere Namen anzeigen
(E,Z)-METHYL 2-HEXENOATEMETHYL 2-HEXENOATE [FHFI]METHYL 2-HEXENOATE, (2E,2Z)-607-296-6925-056-1METHYL 2-HEXENOATEMFCD00048798methyl hexaenoate
Datenbank-Bezeichner
- CAS
2396-77-2- PubChem CID
- 61310
- DTXSID
DTXSID2062375- EC Number
- 607-296-6、925-056-1
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,9
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 105
Experimentelle und physikochemische Eigenschaften
Food AdditivesFLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.911-0.916
Flavoring AgentsEU Flavoring substances
Solubility
Very slightly soluble in water; soluble in oils
Soluble (in ethanol)
Boiling Point168-170 °C
Refractive Index1.423-1.429
Physical DescriptionColourless mobile liquid; Fruity aroma
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 156 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 2-Hexenoic acid, methyl ester
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
2-Hexenoic acid, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Chemie und Industrie
Verwendung und Herstellung
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing Information2-Hexenoic acid, methyl ester: ACTIVE
Zugehörige Reaktionen
2
Verknüpfte Notizen
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