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

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

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

Molecular Formula	C11H16O3
Molecular Weight	196.2429
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 `Sat Dec 16 12:04:30 GMT 2023` Edited by `admin` on `Sat Dec 16 12:04:30 GMT 2023`
Record UNII	Z8K2HEA7BG
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

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

Systematic 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

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

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80190115

Created by admin on Sat Dec 16 12:04:30 GMT 2023 , Edited by admin on Sat Dec 16 12:04:30 GMT 2023

PRIMARY

CAS

3666-84-0

Created by admin on Sat Dec 16 12:04:30 GMT 2023 , Edited by admin on Sat Dec 16 12:04:30 GMT 2023

PRIMARY

ECHA (EC/EINECS)

222-929-2

Created by admin on Sat Dec 16 12:04:30 GMT 2023 , Edited by admin on Sat Dec 16 12:04:30 GMT 2023

PRIMARY

FDA UNII

Z8K2HEA7BG

Created by admin on Sat Dec 16 12:04:30 GMT 2023 , Edited by admin on Sat Dec 16 12:04:30 GMT 2023

PRIMARY

PUBCHEM

77235

Created by admin on Sat Dec 16 12:04:30 GMT 2023 , Edited by admin on Sat Dec 16 12:04:30 GMT 2023

PRIMARY