Basic information
- CAS
73692-69-0- Standard SMILES
Cc1ccc(O)c(=O)o1- InChIKey
MJIACMMODTYUHG-UHFFFAOYSA-N- Molecular formula
- C6H6O3
- Average molar mass
- 126.11 g/mol
- Monoisotopic mass
- 126.03169405
Names & identifiers
- Preferred name
- 3-hydroxy-6-methyl-2(2H)-pyranone
- IUPAC
- 3-hydroxy-6-methylpyran-2-one
Names & synonyms
3-hydroxy-6-methyl-2(2H)-pyranone73692-69-0DTXSID50423886RefChem:279919DTXCID10374724MJIACMMODTYUHG-UHFFFAOYSA-N3-Hydroxy-6-methyl-2H-pyran-2-oneSCHEMBL1521973SCHEMBL1521976
Database identifiers
- CAS
73692-69-0- PubChem CID
- 6428992
- DTXSID
DTXSID50423886- Nikkaji
- J827.776A
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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