4-Hydroxy-2,3-dimethoxyxanthone
Basic information
- CAS
10527-38-5- Standard SMILES
COc1cc2c(=O)c3ccccc3oc2c(O)c1OC- InChIKey
HWDHDJJDOUMUHF-UHFFFAOYSA-N- Molecular formula
- C15H12O5
- Average molar mass
- 272.25 g/mol
- Monoisotopic mass
- 272.06847348
Overview
NSC661742 has been reported in Hypericum japonicum, Kielmeyera rupestris, and other organisms with data available.
Names & identifiers
- Preferred name
- 4-Hydroxy-2,3-dimethoxyxanthone
- IUPAC
- 4-hydroxy-2,3-dimethoxyxanthen-9-one
- English name
- 4-Hydroxy-2,3-dimethoxyxanthone
- Molecular formula
- C15H12O5
- Molecular weight
- 272.25
Names & synonyms
4-hydroxy-2,3-dimethoxyxanthone10527-38-54-hydroxy-2,3-dimethoxyxanthen-9-one4-Hydroxy-2,3-dimethoxy-9H-xanthen-9-one9H-Xanthen-9-one, 4-hydroxy-2,3-dimethoxy-NSC6617424-hydroxy-2,3-dimethoxy-xanthen-9-oneorb1680833CHEMBL3814641DTXSID00327502KAA52738TN5905
Show more names
2,3-Dimethoxy-4-hydroxyxanthone
AKOS030562761NSC-661742F92794
Database identifiers
- CAS
10527-38-5- PubChem CID
- 378690
- DTXSID
DTXSID00327502- ChEMBL
CHEMBL3814641- Nikkaji
- J167.449H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 371
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Related reactions
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Compound notes
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