Structure via PubChem · Public domain (PubChem)
dehydroacetic acid
Sign in to saveAlso known as 3-acetyl-4-hydroxy-6-methyl-2H-pyran-2-one
chemical compound
Chemical data
- Formula
- C8H8O4
- Molecular weight
- 168.15 g/mol
- IUPAC name
- 3-acetyl-4-hydroxy-6-methylpyran-2-one
- SMILES
- CC1=CC(=C(C(=O)O1)C(=O)C)O
- InChIKey
- PKLPQOJFHFGVBS-UHFFFAOYSA-N
- XLogP
- 1
- Polar surface area
- 63.6 Ų
- H-bond donors
- 1
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Subclass of
- chemical compound
- Has part
- carbon
- Mass
- 168.042258736
- Has use
- food additive
Show 3 more facts
- canonical SMILES
- CC1=CC(=O)C(=C(O1)O)C(=O)C
- chemical formula
- C₈H₈O₄
- NCI Thesaurus ID
- C80894
Sources (2)
via Wikidata · CC0