METHYL 2-ACETYL-2-ALLYLPENT-4-ENE-1-OATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H16O3
Molecular Weight	196.2429
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 2-ACETYL-2-ALLYLPENT-4-ENE-1-OATE

Structure Search

SMILES

COC(=O)C(CC=C)(CC=C)C(C)=O

InChI

InChIKey=XUTUUQIIEPJMJI-UHFFFAOYSA-N

InChI=1S/C11H16O3/c1-5-7-11(8-6-2,9(3)12)10(13)14-4/h5-6H,1-2,7-8H2,3-4H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

METHYL 2-ACETYL-2-ALLYLPENT-4-ENE-1-OATE

Systematic Name

English

2-ACETYL-2-(2-PROPENYL)-4-PENTENOIC ACID METHYL ESTER

Preferred Name

English

4-PENTENOIC ACID, 2-ACETYL-2-(2-PROPEN-1-YL)-, METHYL ESTER

Systematic Name

English

METHYL 2-ACETYL-2-ALLYLPENT-4-ENOATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80190115

Created by admin on Tue Apr 01 18:07:10 GMT 2025 , Edited by admin on Tue Apr 01 18:07:10 GMT 2025

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CAS

3666-84-0

Created by admin on Tue Apr 01 18:07:10 GMT 2025 , Edited by admin on Tue Apr 01 18:07:10 GMT 2025

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ECHA (EC/EINECS)

222-929-2

Created by admin on Tue Apr 01 18:07:10 GMT 2025 , Edited by admin on Tue Apr 01 18:07:10 GMT 2025

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FDA UNII

Z8K2HEA7BG

Created by admin on Tue Apr 01 18:07:10 GMT 2025 , Edited by admin on Tue Apr 01 18:07:10 GMT 2025

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PUBCHEM

77235

Created by admin on Tue Apr 01 18:07:10 GMT 2025 , Edited by admin on Tue Apr 01 18:07:10 GMT 2025

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SUBSTANCE RECORD


					Z8K2HEA7BG

METHYL 2-ACETYL-2-ALLYLPENT-4-ENE-1-OATE