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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,5E)-2,5-heptadienoate

SMILES

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

InChI

InChIKey=AEKZTVSCWKESCZ-FZWLCVONSA-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

Approval Year

Unknown
149124
Name Type Language
2,5-Heptadienoic acid, methyl ester, (2E,5E)-
Preferred Name English
Methyl (2E,5E)-2,5-heptadienoate
Systematic Name English
Code System Code Type Description
CAS
41792-07-8
Created by admin on Wed Apr 02 18:40:03 GMT 2025 , Edited by admin on Wed Apr 02 18:40:03 GMT 2025
PRIMARY
FDA UNII
RY8JU6C6B9
Created by admin on Wed Apr 02 18:40:03 GMT 2025 , Edited by admin on Wed Apr 02 18:40:03 GMT 2025
PRIMARY
PUBCHEM
6393835
Created by admin on Wed Apr 02 18:40:03 GMT 2025 , Edited by admin on Wed Apr 02 18:40:03 GMT 2025
PRIMARY
NIH
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