1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16O
Molecular Weight	176.2548
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE

Structure Search

SMILES

CCC1=CC=C(C(C)=O)C(CC)=C1

InChI

InChIKey=DAMITWKYTRCTAO-UHFFFAOYSA-N

InChI=1S/C12H16O/c1-4-10-6-7-12(9(3)13)11(5-2)8-10/h6-8H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C12H16O
Molecular Weight	176.2548
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 `Mon Mar 31 22:10:23 GMT 2025` Edited by `admin` on `Mon Mar 31 22:10:23 GMT 2025`
Record UNII	5MJ1D14W7W
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHANONE, 1-(2,4-DIETHYLPHENYL)-

Preferred Name

English

1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

5MJ1D14W7W

Created by admin on Mon Mar 31 22:10:23 GMT 2025 , Edited by admin on Mon Mar 31 22:10:23 GMT 2025

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PUBCHEM

104114

Created by admin on Mon Mar 31 22:10:23 GMT 2025 , Edited by admin on Mon Mar 31 22:10:23 GMT 2025

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ECHA (EC/EINECS)

257-727-3

Created by admin on Mon Mar 31 22:10:23 GMT 2025 , Edited by admin on Mon Mar 31 22:10:23 GMT 2025

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CAS

52191-01-2

Created by admin on Mon Mar 31 22:10:23 GMT 2025 , Edited by admin on Mon Mar 31 22:10:23 GMT 2025

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EPA CompTox

DTXSID2068715

Created by admin on Mon Mar 31 22:10:23 GMT 2025 , Edited by admin on Mon Mar 31 22:10:23 GMT 2025

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