Molecule ID: 6276412

IUPAC Name: (2E,5E)-6-hydroxy-4-oxohexa-2,5-dienoic acid

Description: The molecule is a muconic semialdehyde that is hexa-2,4-dienoic acid substituted at positions 4 and 6 by hydroxy and oxo groups respectively (the 2E,4Z-isomer). It is a muconic semialdehyde and a 3-oxo aldehyde. It is a conjugate acid of a (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoate.

SMILES: O=C(O)/C=C/C(=O)/C=C/O

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

InChI: InChI=1S/C6H6O4/c7-4-3-5(8)1-2-6(9)10/h1-4,7H,(H,9,10)/b2-1+,4-3+

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 0.2