Grundinformationen
- Standard-SMILES
CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC- InChIKey
LADGBHLMCUINGV-UHFFFAOYSA-N- Summenformel
- C33H62O6
- Durchschnittliche Molmasse
- 554,8 g/mol
- Monoisotopische Masse
- 554,4546397
Überblick
Tricaprin is a triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by capric (decanoic) acid. It is a triglyceride and a decanoate ester.
Namen und Bezeichner
- Bevorzugter Name
- Tricaprin
- IUPAC
- 2,3-di(decanoyloxy)propyl decanoate
- Lokaler Name
- Glycerintridecanoat
- Englischer Name
- TRICAPRIN
- Summenformel
- C33H62O6
- Molmasse
- 554.84
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
621-71-6- PubChem CID
- 69310
- DTXSID
DTXSID1042651- ChEBI
CHEBI:77388- UNII
- O1PB8EU98M
- EC Number
- 210-702-0
- Nikkaji
- J95.465I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 12,2
- Polarare Oberfläche (TPSA)
- 78,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 32
- Schwere Atome
- 39
- Formalladung
- 0
- Komplexität
- 543
Experimentelle und physikochemische Eigenschaften
Cosmetics
Cosmetic ingredients (Tricaprin) -> CIR (Cosmetic Ingredient Review)
Personal care product -> emollient
Emollient; Skin conditioning; Solvent
Physikochemische Eigenschaften
- Schmelzpunkt
- 31 · 31-32 °C
- Siedepunkt
- 254 °C · 254 °C / 5mmHg
- Dichte
- 0.98 g/ml · approximate 0.98 g/ml (20℃)
- Brechungsindex
- 1.44 · approximate 1.44
- Flammpunkt
- 20 °C · 20 °C
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- Chloroform (Sparingly), DMSO (Slightly, Sonicated)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- BRN
- 1717683 · 1717683
- Kosmetik-Inhaltsstoffe Funktionen
- SKIN CONDITIONINGFRAGRANCEPERFUMING
- InChI
- 1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3
- InChIKey
- LADGBHLMCUINGV-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC
- LogP
- 12.444 · 12.444 (est)
- CAS Datenbank
- 621 · 621-71-6(CAS DataBase Reference)
- EPA chemische Informationen
- Glycerol tridecanoate (621-71-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (8 of 8) of all reports.
Not Classified
Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: Decanoic acid, 1,2,3-propanetriyl ester
Decanoic acid, 1,2,3-propanetriyl ester: Does not have an individual approval but may be used under an appropriate group standard
Toxikologische Informationen
Sicherheitsdaten
- wgk
- -
- tsca
- TSCA listed
- ridadr
- UN 1282 3/PG 2
- hs_code
- 29171900
- RTECS-Nr.
- HE0100000
- risk_code
- 11-20/21/22
- hazard_code
- F,Xn
- safety_code
- 26-28
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
Verwendung und Herstellung
Anwendungen
Beschreibung1,2,3-Tridecanoyl glycerol is a triacylglycerol that contains decanoic acid at the sn-1, sn-2, and sn-3 positions. It has been found in human breast milk. 1,2,3-Tridecanoyl glycerol has been used as a standard for the quantification of triacylglycerols in fish oils by RP-HPLC. Formulations containing 1,2,3-tridecanoyl glycerol have been used in cosmetic products as thickening and skin-conditioning agents.
VerwendenTricaprin is used to construct solid lipid nanoparticles (SLNs) as delivery system for bromocriptine (B682600, Mesylate salt). It is also used in cationic SLNs to enhance p53 tumor suppressor gene transfer to lung cancer cells.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Ergänzende Hinweise
DefinitionChEBI: A triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by capric (decanoic) acid.
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