Molecule ID: 21902650

IUPAC Name: (E)-oct-2-enoate

Description: The molecule is a monounsaturated fatty acid anion that is the conjugate base of (2E)-oct-2-enoic acid. Major species at pH 7.3. It is a monounsaturated fatty acid anion and a medium-chain fatty acid anion. It is a conjugate base of a (2E)-oct-2-enoic acid.

SMILES: CCCCC/C=C/C(=O)[O-]

SELFIES: [C][C][C][C][C][/C][=C][/C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/p-1/b7-6+

Molecular Properties:
- Polar Surface Area: 40.1 Ų
- LogP: 3.3