Basic information
- CAS
3376-48-5- Standard SMILES
CCCCCCCCCC(=O)OC(CO)CO- InChIKey
IYVVKFYDGRJWTR-UHFFFAOYSA-N- Molecular formula
- C13H26O4
- Average molar mass
- 246.34 g/mol
- Monoisotopic mass
- 246.18310931
Overview
2-decanoylglycerol is a 2-monoglyceride where the acyl group is decanoyl (caprinoyl). It is a 2-monoglyceride and a monodecanoylglycerol.
Names & identifiers
- Preferred name
- 2-Monocaprin
- IUPAC
- 1,3-dihydroxypropan-2-yl decanoate
- English name
- 2-O-Decanoylglycerol
- Molecular formula
- C13H26O4
- Molecular weight
- 246.34
Names & synonyms
Glyceryl 2-caprate3376-48-52-monocaprinDecanoic acid, 2-hydroxy-1-(hydroxymethyl)ethyl esterP9JHW7Y133DTXSID50187431RefChem:143797DTXCID601099221,3-dihydroxypropan-2-yl decanoateDecanoin, 2-mono-2-O-Decanoylglycerol2-Decanoyl glycerol
Show more names
MG (0:0/10:0/0:0)Glycerin 2-caprate2-O-Decanoylglycerin2-caprate 2-monocaprinMonostearin Impurity 42
Decanoic acid 2-monoglyceride2-decanoylglycerolUNII-P9JHW7Y1332-caprinoylglycerolglycerin monocaprate2-monodecanoylglycerolstarbld0009154SCHEMBL290487
Database identifiers
- CAS
3376-48-5- PubChem CID
- 137910
- DTXSID
DTXSID50187431- ChEBI
CHEBI:75452- UNII
- P9JHW7Y133
- Nikkaji
- J102.876F
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 178
Experimental & physicochemical properties
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 309.35 °C · 309.35°C (rough estimate)
- Density
- 0.974 · 0.9740 (rough estimate)
- refractive index
- 1.428 · 1.4280 (estimate)
- pka
- 13.54 · 13.54±0.10(Predicted)
- FDA UNII
- 9 JHW7Y133 · P9JHW7Y133
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers7 total
上海仲因实业有限公司2537653158 16621191650 · [email protected]
广州安励合生物科技有限公司13928234501 18098185186 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
梯尔希（南京）药物研发有限公司18012923235 · [email protected]
佛山合硕医药科技有限公司15363639686 · [email protected]
Additional notes
DefinitionChEBI: A 2-monoglyceride where the acyl group is decanoyl (caprinoyl).
Related reactions
1 records
Compound notes
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