Bis(2-ethylbutyl) azelate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H40O4
Molecular Weight	356.5399
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Bis(2-ethylbutyl) azelate

Structure Search

SMILES

CCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CC

InChI

InChIKey=HFEFYTCEBRSONX-UHFFFAOYSA-N

InChI=1S/C21H40O4/c1-5-18(6-2)16-24-20(22)14-12-10-9-11-13-15-21(23)25-17-19(7-3)8-4/h18-19H,5-17H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C21H40O4
Molecular Weight	356.5399
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 `Sat Dec 16 19:48:03 GMT 2023` Edited by `admin` on `Sat Dec 16 19:48:03 GMT 2023`
Record UNII	R9MA8MQ4SC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Bis(2-ethylbutyl) azelate

Systematic Name

English

Nonanedioic acid, 1,9-bis(2-ethylbutyl) ester

Systematic Name

English

1,9-Bis(2-ethylbutyl) nonanedioate

Systematic Name

English

Code System Code Type Description

FDA UNII

R9MA8MQ4SC

Created by admin on Sat Dec 16 19:48:03 GMT 2023 , Edited by admin on Sat Dec 16 19:48:03 GMT 2023

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PUBCHEM

66920

Created by admin on Sat Dec 16 19:48:03 GMT 2023 , Edited by admin on Sat Dec 16 19:48:03 GMT 2023

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CAS

105-03-3

Created by admin on Sat Dec 16 19:48:03 GMT 2023 , Edited by admin on Sat Dec 16 19:48:03 GMT 2023

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ECHA (EC/EINECS)

203-263-1

Created by admin on Sat Dec 16 19:48:03 GMT 2023 , Edited by admin on Sat Dec 16 19:48:03 GMT 2023

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EPA CompTox

DTXSID70146904

Created by admin on Sat Dec 16 19:48:03 GMT 2023 , Edited by admin on Sat Dec 16 19:48:03 GMT 2023

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