Glyceryl trinonanoate - CAS 126-53-4

Catalog:	BB006596
Product Name:	Glyceryl trinonanoate
CAS:	126-53-4
Synonyms:	2,3-di(nonanoyloxy)propyl nonanoate

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	2,3-di(nonanoyloxy)propyl nonanoate
Description:	Glyceryl trinonanoate (CAS# 126-53-4) is an analog of Tricaproin (T773780) which is used as a delivery system for Paclitaxel (P132500), an anticancer agent.
Molecular Weight:	512.76
Molecular Formula:	C30H56O6
Canonical SMILES:	CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC)OC(=O)CCCCCCCC
InChI:	InChI=1S/C30H56O6/c1-4-7-10-13-16-19-22-28(31)34-25-27(36-30(33)24-21-18-15-12-9-6-3)26-35-29(32)23-20-17-14-11-8-5-2/h27H,4-26H2,1-3H3
InChI Key:	YRIMSXJXBHUHJT-UHFFFAOYSA-N
Boiling Point:	544.1 ℃ at 760 mmHg
Density:	0.943 g/mL at 20℃(lit.)
MDL:	MFCD00042912
LogP:	8.23640

Publication Number	Title	Priority Date
KR-20210029745-A	Pharmaceutical compositions for oral administration in the form of powder comprising an anti-viral drug	20210303
CN-110357750-B	Composite oil phase for emulsion explosive, preparation method of composite oil phase, emulsion matrix and emulsion explosive	20190731
CN-110283670-B	Special carbon deposition cleaning agent for three-way catalyst for direct injection engine	20190715
WO-2020251294-A1	Pharmaceutical composition for oral administration in powder formulation containing antiviral agent	20190614
KR-20200142943-A	Pharmaceutical compositions for oral administration in the form of powder comprising an anti-viral drug	20190614

PMID	Publication Date	Title	Journal
21262136	20101201	Blood D-(-)-3-hydroxybutyrate concentrations after oral administration of trioctanoin, trinonanoin, or tridecanoin to newborn rhesus monkeys (Macaca mulatta)	Comparative medicine
12238154	20020601	Flavor production from edible oils and their constituents by Penicillium corylophilum	Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Complexity:	502
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	512.4076895
Formal Charge:	0
Heavy Atom Count:	36
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	512.4076895
Rotatable Bond Count:	29
Topological Polar Surface Area:	78.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	10.6