Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H13NO3
Molecular Weight	207.2258
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate

Structure Search

SMILES

CCOC(=O)CC(=O)C1=CC=C(C)N=C1

InChI

InChIKey=CSTIAWJADKPHBF-UHFFFAOYSA-N

InChI=1S/C11H13NO3/c1-3-15-11(14)6-10(13)9-5-4-8(2)12-7-9/h4-5,7H,3,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C11H13NO3
Molecular Weight	207.2258
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 18:52:21 GMT 2025` Edited by `admin` on `Tue Apr 01 18:52:21 GMT 2025`
Record UNII	5C6ZE85DD3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Pyridinepropanoic acid, 6-methyl-?-oxo-, ethyl ester

Preferred Name

English

Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate

Systematic Name

English

ethyl 3-(6-methylpyridin-3-yl)-3-oxopropanoate

Systematic Name

English

Ethyl 6-methyl-?-oxo-3-pyridinepropanoate

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

244-529-7

Created by admin on Tue Apr 01 18:52:21 GMT 2025 , Edited by admin on Tue Apr 01 18:52:21 GMT 2025

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FDA UNII

5C6ZE85DD3

Created by admin on Tue Apr 01 18:52:21 GMT 2025 , Edited by admin on Tue Apr 01 18:52:21 GMT 2025

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CAS

21683-58-9

Created by admin on Tue Apr 01 18:52:21 GMT 2025 , Edited by admin on Tue Apr 01 18:52:21 GMT 2025

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PUBCHEM

89013

Created by admin on Tue Apr 01 18:52:21 GMT 2025 , Edited by admin on Tue Apr 01 18:52:21 GMT 2025

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EPA CompTox

DTXSID00176072

Created by admin on Tue Apr 01 18:52:21 GMT 2025 , Edited by admin on Tue Apr 01 18:52:21 GMT 2025

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