Basic information
- CAS
61350-59-2- Standard SMILES
COc1cc(OC)c2c(c1)OC(O)CC2=O- InChIKey
OAKWGKAJZBAEKT-UHFFFAOYSA-N- Molecular formula
- C11H12O5
- Average molar mass
- 224.21 g/mol
- Monoisotopic mass
- 224.06847348
Names & identifiers
- Preferred name
- 2-Hydroxy-5,7-dimethoxychroman-4-one
- IUPAC
- 2-hydroxy-5,7-dimethoxy-2,3-dihydrochromen-4-one
Names & synonyms
2-hydroxy-5,7-dimethoxychroman-4-one61350-59-22-hydroxy-5,7-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-oneDTXSID104952462-Hydroxy-5,7-dimethoxy-2,3-dihydro-4H-1-benzopyran-4-one
Database identifiers
- CAS
61350-59-2- PubChem CID
- 12378002
- DTXSID
DTXSID10495246
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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