4-(3-ETHOXY-4-HYDROXYPHENYL)-2-BUTANONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16O3
Molecular Weight	208.2536
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(3-ETHOXY-4-HYDROXYPHENYL)-2-BUTANONE

Structure Search

SMILES

CCOC1=CC(CCC(C)=O)=CC=C1O

InChI

InChIKey=MXLOKFOWFPJWCW-UHFFFAOYSA-N

InChI=1S/C12H16O3/c1-3-15-12-8-10(5-4-9(2)13)6-7-11(12)14/h6-8,14H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H16O3
Molecular Weight	208.2536
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 `Wed Apr 02 18:29:27 GMT 2025` Edited by `admin` on `Wed Apr 02 18:29:27 GMT 2025`
Record UNII	TH7XI54W45
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HYDROXYETHOXYPHENYL BUTANONE

Preferred Name

English

4-(3-ETHOXY-4-HYDROXYPHENYL)-2-BUTANONE

Systematic Name

English

2-BUTANONE, 4-(3-ETHOXY-4-HYDROXYPHENYL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

45094126

Created by admin on Wed Apr 02 18:29:27 GMT 2025 , Edited by admin on Wed Apr 02 18:29:27 GMT 2025

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EPA CompTox

DTXSID101278928

Created by admin on Wed Apr 02 18:29:27 GMT 2025 , Edited by admin on Wed Apr 02 18:29:27 GMT 2025

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CHEBI

172922

Created by admin on Wed Apr 02 18:29:27 GMT 2025 , Edited by admin on Wed Apr 02 18:29:27 GMT 2025

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FDA UNII

TH7XI54W45

Created by admin on Wed Apr 02 18:29:27 GMT 2025 , Edited by admin on Wed Apr 02 18:29:27 GMT 2025

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CAS

569646-79-3

Created by admin on Wed Apr 02 18:29:27 GMT 2025 , Edited by admin on Wed Apr 02 18:29:27 GMT 2025

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