Methyl (2E,5Z)-2,5-heptadienoate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H12O2
Molecular Weight	140.1797
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of Methyl (2E,5Z)-2,5-heptadienoate

Structure Search

SMILES

COC(=O)\C=C\C\C=C/C

InChI

InChIKey=AEKZTVSCWKESCZ-WWVFNRLHSA-N

InChI=1S/C8H12O2/c1-3-4-5-6-7-8(9)10-2/h3-4,6-7H,5H2,1-2H3/b4-3-,7-6+

HIDE SMILES / InChI

Molecular Formula	C8H12O2
Molecular Weight	140.1797
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	2
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:47:26 GMT 2025` Edited by `admin` on `Wed Apr 02 18:47:26 GMT 2025`
Record UNII	W3XZ58HR9P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,5-Heptadienoic acid, methyl ester, (2E,5Z)-

Preferred Name

English

Methyl (2E,5Z)-2,5-heptadienoate

Systematic Name

English

Code System Code Type Description

PUBCHEM

131877834

Created by admin on Wed Apr 02 18:47:26 GMT 2025 , Edited by admin on Wed Apr 02 18:47:26 GMT 2025

PRIMARY

CAS

18261-30-8

Created by admin on Wed Apr 02 18:47:26 GMT 2025 , Edited by admin on Wed Apr 02 18:47:26 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

CAS

32793-93-4

Created by admin on Wed Apr 02 18:47:26 GMT 2025 , Edited by admin on Wed Apr 02 18:47:26 GMT 2025

PRIMARY

EPA CompTox

DTXSID501301802

Created by admin on Wed Apr 02 18:47:26 GMT 2025 , Edited by admin on Wed Apr 02 18:47:26 GMT 2025

PRIMARY

FDA UNII

W3XZ58HR9P

Created by admin on Wed Apr 02 18:47:26 GMT 2025 , Edited by admin on Wed Apr 02 18:47:26 GMT 2025

PRIMARY