ISOOCTYL STEARATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H52O2
Molecular Weight	396.6899
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOOCTYL STEARATE

Structure Search

SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCCCCC(C)C

InChI

InChIKey=SJIDAAGFCNIAJP-UHFFFAOYSA-N

InChI=1S/C26H52O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-26(27)28-24-21-18-19-22-25(2)3/h25H,4-24H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C26H52O2
Molecular Weight	396.6899
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 `Wed Apr 02 10:31:12 GMT 2025` Edited by `admin` on `Wed Apr 02 10:31:12 GMT 2025`
Record UNII	TY4NB66VFF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOOCTYL STEARATE

Preferred Name

English

Code System Code Type Description

FDA UNII

TY4NB66VFF

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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ECHA (EC/EINECS)

254-970-7

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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SMS_ID

100000092921

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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EPA CompTox

DTXSID5068237

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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CAS

40550-16-1

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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PUBCHEM

162416

Created by admin on Wed Apr 02 10:31:12 GMT 2025 , Edited by admin on Wed Apr 02 10:31:12 GMT 2025

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