PENTAERYTHRITYL TRICAPRYLATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H54O7
Molecular Weight	514.7349
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAERYTHRITYL TRICAPRYLATE

Structure Search

SMILES

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

InChI

InChIKey=DXUVYLAXKZHXPW-UHFFFAOYSA-N

InChI=1S/C29H54O7/c1-4-7-10-13-16-19-26(31)34-23-29(22-30,24-35-27(32)20-17-14-11-8-5-2)25-36-28(33)21-18-15-12-9-6-3/h30H,4-25H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C29H54O7
Molecular Weight	514.7349
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:08:43 GMT 2025` Edited by `admin` on `Mon Mar 31 22:08:43 GMT 2025`
Record UNII	Z808H25F4M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OCTANOIC ACID, 2-(HYDROXYMETHYL)-2-(((1-OXOOCTYL)OXY)METHYL)-1,3-PROPANEDIYL ESTER

Preferred Name

English

PENTAERYTHRITYL TRICAPRYLATE

Common Name

English

PENTAERYTHRITOL TRICAPRYLATE

Systematic Name

English

Code System Code Type Description

FDA UNII

Z808H25F4M

Created by admin on Mon Mar 31 22:08:43 GMT 2025 , Edited by admin on Mon Mar 31 22:08:43 GMT 2025

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CAS

59400-09-8

Created by admin on Mon Mar 31 22:08:43 GMT 2025 , Edited by admin on Mon Mar 31 22:08:43 GMT 2025

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ECHA (EC/EINECS)

261-735-2

Created by admin on Mon Mar 31 22:08:43 GMT 2025 , Edited by admin on Mon Mar 31 22:08:43 GMT 2025

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EPA CompTox

DTXSID70208132

Created by admin on Mon Mar 31 22:08:43 GMT 2025 , Edited by admin on Mon Mar 31 22:08:43 GMT 2025

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PUBCHEM

101038

Created by admin on Mon Mar 31 22:08:43 GMT 2025 , Edited by admin on Mon Mar 31 22:08:43 GMT 2025

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