N-ETHYLHEXYLONE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H21NO3
Molecular Weight	263.3321
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-ETHYLHEXYLONE

Structure Search

SMILES

CCCCC(NCC)C(=O)C1=CC2=C(OCO2)C=C1

InChI

InChIKey=YBBDXHZYADMVNJ-UHFFFAOYSA-N

InChI=1S/C15H21NO3/c1-3-5-6-12(16-4-2)15(17)11-7-8-13-14(9-11)19-10-18-13/h7-9,12,16H,3-6,10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C15H21NO3
Molecular Weight	263.3321
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 05:34:21 GMT 2025` Edited by `admin` on `Wed Apr 02 05:34:21 GMT 2025`
Record UNII	4906KZK4YO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-ETHYLHEXYLONE

Common Name

English

N-ETHYLHEXYLONE [NFLIS-DRUG]

Preferred Name

English

HEXANOPHENONE, 2-(ETHYLAMINO)-3',4'-(METHYLENEDIOXY)-

Systematic Name

English

1-HEXANONE, 1-(1,3-BENZODIOXOL-5-YL)-2-(ETHYLAMINO)-

Systematic Name

English

1-(2H-1,3-BENZODIOXOL-5-YL)-2-(ETHYLAMINO)HEXAN-1-ONE

Systematic Name

English

Code System Code Type Description

CAS

802605-02-3

Created by admin on Wed Apr 02 05:34:21 GMT 2025 , Edited by admin on Wed Apr 02 05:34:21 GMT 2025

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FDA UNII

4906KZK4YO

Created by admin on Wed Apr 02 05:34:21 GMT 2025 , Edited by admin on Wed Apr 02 05:34:21 GMT 2025

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EPA CompTox

DTXSID901342199

Created by admin on Wed Apr 02 05:34:21 GMT 2025 , Edited by admin on Wed Apr 02 05:34:21 GMT 2025

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WIKIPEDIA

N-Ethylhexylone

Created by admin on Wed Apr 02 05:34:21 GMT 2025 , Edited by admin on Wed Apr 02 05:34:21 GMT 2025

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PUBCHEM

137700399

Created by admin on Wed Apr 02 05:34:21 GMT 2025 , Edited by admin on Wed Apr 02 05:34:21 GMT 2025

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