Tricaprilin 1g

CAT: 0628-A18190-1000Size: 1000 mgDry Ice: NoHazardous: No

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CAT#:0628-A18190-1000Size:1000 mg

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CAS Number

538-23-8

Chemical Information

Tricaprylin

Trioctanoin is a triglyceride obtained by acylation of the three hydroxy groups of glycerol by octanoic acid. Used as an alternative energy source to glucose for patients with mild to moderate Alzheimer's disease. It has a role as an anticonvulsant and a plant metabolite. It is a triglyceride and an octanoate ester.

CAS Number	538-23-8
PubChem CID	10850
IUPAC Name	2,3-di(octanoyloxy)propyl octanoate
Molecular Formula	C27H50O6
Molecular Weight	470.7
XLogP	8.9
Topological Polar Surface Area	78.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	26
Heavy Atom Count	33
Formal Charge	0
Complexity	461

SMILES

CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC

InChI

InChI=1S/C27H50O6/c1-4-7-10-13-16-19-25(28)31-22-24(33-27(30)21-18-15-12-9-6-3)23-32-26(29)20-17-14-11-8-5-2/h24H,4-23H2,1-3H3

InChIKey

VLPFTAMPNXLGLX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 538-23-8

CID: 10850

Formula: C27H50O6

MW: 470.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	470.7
XLogP3	8.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	26
Exact Mass	470.36073931
Monoisotopic Mass	470.36073931
Topological Polar Surface Area	78.9 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	461
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-B1804-01	Tricaprilin
HY-B1804S2-01	Tricaprilin-d15
HY-B1804S1-01	Tricaprilin-d50
HY-B1804S	Tricaprilin-13C3
HY-B1804R-01	Tricaprilin (Standard)

Tricaprilin 1g

Chemical Information

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