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Home Other Building Blocks 1,3-Dioctanoin

1,3-Dioctanoin

CAS No.:
1429-66-9
Catalog Number:
AG003ATR
Molecular Formula:
C19H36O5
Molecular Weight:
344.4861
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Product Description
Catalog Number:
AG003ATR
Chemical Name:
1,3-Dioctanoin
CAS Number:
1429-66-9
Molecular Formula:
C19H36O5
Molecular Weight:
344.4861
MDL Number:
MFCD00056316
IUPAC Name:
(2-hydroxy-3-octanoyloxypropyl) octanoate
InChI:
InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-15-17(20)16-24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3
InChI Key:
DMBAVJVECSKEPF-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)O
UNII:
NEW0U7C3IV
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.256g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
344.492g/mol
Monoisotopic Mass:
344.256g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4  
Literature
Title Journal
Drug-excipient complexation in lipid based delivery systems: an investigation of the Tipranavir-1,3-dioctanolyglycerol complex. Journal of pharmaceutical sciences 20090501
The role of PI 3-kinase in EGF-stimulated jejunal glucose transport. Canadian journal of physiology and pharmacology 20020101
Separation of glyceride positional isomers by silver ion chromatography. Journal of chromatography. A 20010720
Properties