ETHYL 3,3-DIMETHYLPENT-4-ENOATE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H16O2
Molecular Weight	156.2221
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 3,3-DIMETHYLPENT-4-ENOATE

Structure Search

SMILES

CCOC(=O)CC(C)(C)C=C

InChI

InChIKey=ZLDOMUPTDYCDBS-UHFFFAOYSA-N

InChI=1S/C9H16O2/c1-5-9(3,4)7-8(10)11-6-2/h5H,1,6-7H2,2-4H3

HIDE SMILES / InChI

Molecular Formula	C9H16O2
Molecular Weight	156.2221
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 21:09:29 GMT 2025` Edited by `admin` on `Tue Apr 01 21:09:29 GMT 2025`
Record UNII	NZ837EQV7A
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-PENTENOIC ACID, 3,3-DIMETHYL-, ETHYL ESTER

Preferred Name

English

ETHYL 3,3-DIMETHYLPENT-4-ENOATE

Systematic Name

English

3,3-DIMETHYL-4-PENTENOIC ACID ETHYL ESTER

Common Name

English

ETHYL 3,3-DIMETHYLPENT-4-EN-1-OATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID5064883

Created by admin on Tue Apr 01 21:09:29 GMT 2025 , Edited by admin on Tue Apr 01 21:09:29 GMT 2025

PRIMARY

CAS

7796-72-7

Created by admin on Tue Apr 01 21:09:29 GMT 2025 , Edited by admin on Tue Apr 01 21:09:29 GMT 2025

PRIMARY

FDA UNII

NZ837EQV7A

Created by admin on Tue Apr 01 21:09:29 GMT 2025 , Edited by admin on Tue Apr 01 21:09:29 GMT 2025

PRIMARY

ECHA (EC/EINECS)

232-250-3

Created by admin on Tue Apr 01 21:09:29 GMT 2025 , Edited by admin on Tue Apr 01 21:09:29 GMT 2025

PRIMARY

PUBCHEM

82262

Created by admin on Tue Apr 01 21:09:29 GMT 2025 , Edited by admin on Tue Apr 01 21:09:29 GMT 2025

PRIMARY