Molecule ID: 5281162

IUPAC Name: ethyl (2E,4Z)-deca-2,4-dienoate

Description: The molecule is a fatty acid ethyl ester resulting from the formal condensation of the carboxy group of (2E,4E)-deca-2,4-dienoic acid with the hydroxy group of ethanol. It has a role as a plant metabolite, a flavouring agent, a fragrance and a kairomone. It derives from a (2E,4E)-deca-2,4-dienoic acid.

SMILES: CCCCC/C=C\C=C\C(=O)OCC

SELFIES: [C][C][C][C][C][/C][=C][\C][=C][\C][=Branch1][C][=O][O][C][C]

InChI: InChI=1S/C12H20O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h8-11H,3-7H2,1-2H3/b9-8-,11-10+

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 4.0