Ethyl Dodecanoate
Grundinformationen
- CAS
1219795-35-3- Standard-SMILES
CCCCCCCCCCCC(=O)OCC- InChIKey
MMXKVMNBHPAILY-UHFFFAOYSA-N- Summenformel
- C14H28O2
- Durchschnittliche Molmasse
- 228,37 g/mol
Überblick
Ethyl laurate is a fatty acid ethyl ester of lauric acid. It has a role as a metabolite.
Namen und Bezeichner
- Bevorzugter Name
- Ethyl Dodecanoate
- IUPAC
- ethyl dodecanoate
- Englischer Name
- Ethyl Dodecanoate-d23
- Summenformel
- C14H28O2
- Molmasse
- 228.38
Namen und Synonyme
ETHYL LAURATEEthyl dodecanoate106-33-2Dodecanoic acid, ethyl esterEthyl laurinateLauric acid, ethyl esterdodecanoic acid ethyl esterFEMA No. 2441DTXSID4047044F389D4MD5KNSC-8912NSC-83467
Weitere Namen anzeigen
Ethyl Dodecanoate-d23Ethyl Dodecanoate-D23 (Standard)ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosadeuteriododecanoate
DTXCID2027044CHEBI:87427RefChem:138924203-386-0Lauric acid ethyl esterEthyl dodecylateEthyl n-dodecanoateEthyllaurate
Datenbank-Bezeichner
- CAS
1219795-35-3- ChEMBL
CHEMBL3187842- ChEBI
CHEBI:87427- UNII
- F389D4MD5K
- EC Number
- 203-386-0
- Nikkaji
- J10.113C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,6
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 12
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 155
Experimentelle und physikochemische Eigenschaften
LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]
CosmeticsEmollient
SpringerMaterials PropertiesBoiling point
FragrancesFragrance Ingredient (Ethyl laurate) -> IFRA transparency List
LogP
5.71
5.71
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.858-0.863
Flavoring AgentsEU Flavoring substances
Solubility
Soluble in ether, insoluble in water
1ml in 9ml 80% ethanol (in ethanol)
Boiling Point
269.00 to 271.00 °C. @ 760.00 mm Hg
269 °C
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 97.6% (1620 of 1659) of all reports.
Not Classified
Aggregated GHS information provided per 1659 reports by companies from 3 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: Dodecanoic acid, ethyl ester
Status: Active Update: 22-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26612
Dodecanoic acid, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Dodecanoic acid, ethyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsExtracellular
Verwendung und Herstellung
Household ProductsInformation on 3 consumer products that contain Ethyl Laurate in the following categories is provided:
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing InformationDodecanoic acid, ethyl ester: ACTIVE
Anwendungen
VerwendenEthyl Dodecanoate-d23 (CAS# 1219795-35-3) is a useful isotopically labeled research compound.
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