Molecule ID: 22495148

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

Description: The molecule is an unsaturated fatty acid anion that is the conjugate base of trans-2-dodecenoic acid obtained by deprotonation of the carboxy group; major species at pH 7.3. It is an unsaturated fatty acid anion and a medium-chain fatty acid anion. It is a conjugate base of a trans-2-dodecenoic acid.

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

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

InChI: InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h10-11H,2-9H2,1H3,(H,13,14)/p-1/b11-10+

Molecular Properties:
- Polar Surface Area: 40.1 Ų
- LogP: 5.5