Octansure, Monoester mit Glycerin

Glyceryl 1-monooctanoate

HCID 3033877CAS 26402-26-6

Grundinformationen

Standard-SMILES
CCCCCCCC(=O)OCC(O)CO
InChIKey
GHBFNMLVSPCDGN-UHFFFAOYSA-N
Summenformel
C11H22O4
Durchschnittliche Molmasse
218,29 g/mol
Monoisotopische Masse
218,15180918

Überblick

1-monooctanoylglycerol is a 1-monoglyceride that has octanoyl as the acyl group. It is a 1-monoglyceride and an octanoate ester.

Namen und Bezeichner

Bevorzugter Name
Glyceryl 1-monooctanoate
IUPAC
2,3-dihydroxypropyl octanoate
Lokaler Name
Octansure, Monoester mit Glycerin
Englischer Name
MONOCAPRYLIN
Summenformel
C11H22O4
Molmasse
218.29

Namen und Synonyme

502-54-5Monoctanoin1-MonocaprylinGlyceryl 1-Monooctanoatealpha-Monocaprylin1-MonooctanoinDL-1-MonooctanoinGlyceryl 1-caprylateOctanoic Acid 1-Monoglyceride1-Monocapryloyl-rac-glycerolOctanoic acid, 2,3-dihydroxypropyl esterGLYCEROL 1-OCTANOATE
Weitere Namen anzeigen
octyl and decyl glycerateGlycerylcaprylateGLYCEROL MONOCAPRYLATE1-MONOOCTANOYL GLYCEROLOCTANOINPoem M-100Sefsol 318monooctanoinDrewmulse CA
Glyceryl-1-caprylateMCF579Z59BRefChem:922333VFU0OU98LO610-514-2Monocaprylin2,3-dihydroxypropyl octanoate26402-26-6

Datenbank-Bezeichner

CAS
26402-26-6、502-54-5
PubChem CID
3033877
DTXSID
DTXSID6048383
ChEMBL
CHEMBL1570482
ChEBI
CHEBI:85241
UNII
MCF579Z59B
EC Number
247-668-1、610-514-2
Nikkaji
J118.316H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2
Polarare Oberfläche (TPSA)
66,8 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
10
Schwere Atome
15

Experimentelle und physikochemische Eigenschaften

Cosmetics · 2 Einträge

Cosmetic ingredients (Glyceryl Caprylate) -> CIR (Cosmetic Ingredient Review)

Emulsifying; Emollient

Human Drugs · 2 Einträge

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Physical DescriptionLiquid

Physikochemische Eigenschaften

Schmelzpunkt
39 to · 39.0 to 43.0 °C
Siedepunkt
296 ℃[at · 296℃[at 101 325 Pa]
Dichte
1.024 · 1.024[at 20℃]
Dampfdruck
0.001 Pa · 0.001Pa at 25℃
storage temp.
20 °C · −20°C
Löslichkeit
100 mg/mL · DMSO : 100 mg/mL (458.11 mM)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 95.8% (113 of 118) of all reports.

Not Classified

Aggregated GHS information provided per 118 reports by companies from 2 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Regulatory Information · 5 Einträge

Chemical: Octanoic acid, monoester with 1,2,3-propanetriol

Octanoic acid, monoester with 1,2,3-propanetriol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Octanoic acid, monoester with 1,2,3-propanetriol are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: Octanoic acid, monoester with glycerol (EC: 247-668-1)

Octanoic acid, monoester with 1,2,3-propanetriol: Does not have an individual approval but may be used under an appropriate group standard

Octanoic acid, 2,3-dihydroxypropyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - Octanoic acid, monoester with 1,2,3-propanetriol: Human health tier I assessment
EPA Safer ChemicalChemical: Octanoic acid, monoester with 1,2,3-propanetriol
Hazard Classes and CategoriesNot Classified

Toxikologische Informationen

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29159000

Chemie und Industrie

Verwendung und Herstellung

UsesCIR ingredient: Glyceryl Caprylate
U.S. Production2023: 32,428 lb
Consumer UsesEmulsifier
Industry UsesEmulsifier
Household ProductsInformation on 12 consumer products that contain Glyceryl Caprylate in the following categories is provided:
Use Classification · 3 Einträge

EPA Safer Chemical Functional Use Classes -> Surfactants

Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern

Cosmetics -> Emulsifying; Emollient

Anwendungen

VerwendenMonocaprylin is used in preparation of Citric Acid mixed grease plasticizer.Also, It is an active agent for skin and hair care with pysicochemistry modifying properties.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Anbieter45 Anbieter

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
宜昌众意泰贸易有限公司0717-6449896 13886658719 · [email protected]

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