2-PROPYLHEXANOIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H18O2
Molecular Weight	158.238
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCC(CCC)C(O)=O

InChI

InChIKey=HWXRWNDOEKHFTL-UHFFFAOYSA-N

InChI=1S/C9H18O2/c1-3-5-7-8(6-4-2)9(10)11/h8H,3-7H2,1-2H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula	C9H18O2
Molecular Weight	158.238
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:25:50 GMT 2025` Edited by `admin` on `Wed Apr 02 10:25:50 GMT 2025`
Record UNII	L5671E148V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-PROPYLHEXANOIC ACID

Systematic Name

English

2-PROPYLHEXANOIC ACID, (±)-

Preferred Name

English

HEXANOIC ACID, 2-PROPYL-

Systematic Name

English

4-OCTANECARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

CAS

3274-28-0

Created by admin on Wed Apr 02 10:25:50 GMT 2025 , Edited by admin on Wed Apr 02 10:25:50 GMT 2025

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PUBCHEM

18647

Created by admin on Wed Apr 02 10:25:50 GMT 2025 , Edited by admin on Wed Apr 02 10:25:50 GMT 2025

PRIMARY

EPA CompTox

DTXSID20875838

Created by admin on Wed Apr 02 10:25:50 GMT 2025 , Edited by admin on Wed Apr 02 10:25:50 GMT 2025

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FDA UNII

L5671E148V

Created by admin on Wed Apr 02 10:25:50 GMT 2025 , Edited by admin on Wed Apr 02 10:25:50 GMT 2025

PRIMARY

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