Ethyl 3-oxo-4-phenoxybutyrate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14O4
Molecular Weight	222.2372
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 3-oxo-4-phenoxybutyrate

Structure Search

SMILES

CCOC(=O)CC(=O)COC1=CC=CC=C1

InChI

InChIKey=SEZPICVFXSJZBS-UHFFFAOYSA-N

InChI=1S/C12H14O4/c1-2-15-12(14)8-10(13)9-16-11-6-4-3-5-7-11/h3-7H,2,8-9H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H14O4
Molecular Weight	222.2372
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 17:59:36 GMT 2025` Edited by `admin` on `Tue Apr 01 17:59:36 GMT 2025`
Record UNII	9PGC28AD3Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Butanoic acid, 3-oxo-4-phenoxy-, ethyl ester

Preferred Name

English

Ethyl 3-oxo-4-phenoxybutyrate

Systematic Name

English

Ethyl 3-oxo-4-phenoxybutanoate

Systematic Name

English

Code System Code Type Description

PUBCHEM

3016246

Created by admin on Tue Apr 01 17:59:36 GMT 2025 , Edited by admin on Tue Apr 01 17:59:36 GMT 2025

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EPA CompTox

DTXSID00194019

Created by admin on Tue Apr 01 17:59:36 GMT 2025 , Edited by admin on Tue Apr 01 17:59:36 GMT 2025

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CAS

41051-18-7

Created by admin on Tue Apr 01 17:59:36 GMT 2025 , Edited by admin on Tue Apr 01 17:59:36 GMT 2025

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FDA UNII

9PGC28AD3Q

Created by admin on Tue Apr 01 17:59:36 GMT 2025 , Edited by admin on Tue Apr 01 17:59:36 GMT 2025

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ECHA (EC/EINECS)

255-189-4

Created by admin on Tue Apr 01 17:59:36 GMT 2025 , Edited by admin on Tue Apr 01 17:59:36 GMT 2025

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