ChemicalBook--->CAS DataBase List--->502-54-5

502-54-5

502-54-5 Structure

502-54-5 Structure
IdentificationBack Directory
[Name]

MONOCAPRYLIN
[CAS]

502-54-5
[Synonyms]

OCTANOIN
Moctanin
Monoctanoin
Capmul 8210
MONOCAPRYLIN
1-MONOCAPRYLIN
Unii-vfu0ou98lo
DL-1-Monooctanoin
Glycerol 1-octanoate
Glyceryl 1-caprylate
Glycerol Impurity 26
GLYCEROL MONOCAPRYLATE
1-MONOOCTANOYL GLYCEROL
Glycerol-1-monooctanoate
Glyceryl 1-Monooctanoate
(±)-Glycerol Monoctanoate
rac-1-monooctanoylglycerol
1-MONOOCTANOYL-RAC-GLYCEROL
GLYCEROL ALPHA-MONOOCTANOATE
1-Monocapryloyl-rac-glycerol
2,3-Dihydroxypropyl Octanoate
Octanoic Acid 1-Monoglyceride
1-MONOCAPRYLOYL-RAC-GLYCEROL (C8:0)
Octanoic acid, 2,3-dihydroxypropyl ester
[Molecular Formula]

C11H22O4
[MDL Number]

MFCD00056652
[MOL File]

502-54-5.mol
[Molecular Weight]

218.29
Chemical PropertiesBack Directory
[Melting point ]

39.5-40.5°
[Boiling point ]

340.0±22.0 °C(Predicted)
[density ]

1.044±0.06 g/cm3(Predicted)
[storage temp. ]

−20°C
[solubility ]

Soluble in CHCl3:100.0(Max Conc. mg/mL);458.1(Max Conc. mM)
[form ]

A solid
[pka]

13.16±0.20(Predicted)
[color ]

White to off-white
[InChI]

1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
[InChIKey]

GHBFNMLVSPCDGN-UHFFFAOYSA-N
[SMILES]

CCCCCCCC(=O)OCC(O)CO
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

1-Octanoyl-rac-glycerol is a monoacylglyecrol with antibacterial activity. 1-Octanoyl-rac-glycerol showed inhibition of oleic acid uptake by rat intestinal epithelial IEC-6 cells in vitro.
[Uses]

Monocaprylin 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.
[Definition]

ChEBI: 1-monooctanoylglycerol is a 1-monoglyceride that has octanoyl as the acyl group. It is a 1-monoglyceride and an octanoate ester.
[Brand name]

Moctanin (Exelixis).
[Biological Activity]

Monocaprylin (1-octanoyl-rac-glycerol) is used as an antimicrobial monoglycerin with potential to tre at bacteria D congolensis and campylobacter infections and to inactivate E. coliListeria and Salmonella on biosurfaces.
Spectrum DetailBack Directory
[Spectrum Detail]

MONOCAPRYLIN(502-54-5)1HNMR
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