4-ETHYLHEXANOIC ACID

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H16O2
Molecular Weight	144.2114
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-ETHYLHEXANOIC ACID

Structure Search

SMILES

CCC(CC)CCC(O)=O

InChI

InChIKey=KJYXVWHRKCNYKU-UHFFFAOYSA-N

InChI=1S/C8H16O2/c1-3-7(4-2)5-6-8(9)10/h7H,3-6H2,1-2H3,(H,9,10)

HIDE SMILES / InChI

Molecular Formula	C8H16O2
Molecular Weight	144.2114
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 `Tue Apr 01 20:02:09 GMT 2025` Edited by `admin` on `Tue Apr 01 20:02:09 GMT 2025`
Record UNII	COT3ZV32XS
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-44869

Preferred Name

English

4-ETHYLHEXANOIC ACID

Systematic Name

English

HEXANOIC ACID, 4-ETHYL-

Common Name

English

Code System Code Type Description

PUBCHEM

22734

Created by admin on Tue Apr 01 20:02:10 GMT 2025 , Edited by admin on Tue Apr 01 20:02:10 GMT 2025

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CAS

6299-66-7

Created by admin on Tue Apr 01 20:02:10 GMT 2025 , Edited by admin on Tue Apr 01 20:02:10 GMT 2025

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NSC

44869

Created by admin on Tue Apr 01 20:02:10 GMT 2025 , Edited by admin on Tue Apr 01 20:02:10 GMT 2025

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FDA UNII

COT3ZV32XS

Created by admin on Tue Apr 01 20:02:10 GMT 2025 , Edited by admin on Tue Apr 01 20:02:10 GMT 2025

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EPA CompTox

DTXSID80212200

Created by admin on Tue Apr 01 20:02:10 GMT 2025 , Edited by admin on Tue Apr 01 20:02:10 GMT 2025

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