Basic information
- CAS
13261-50-2- Standard SMILES
COc1cccc2c1C(=O)C(=O)C=C2O- InChIKey
MTISENNBNSTRHU-UHFFFAOYSA-N- Molecular formula
- C11H8O4
- Average molar mass
- 204.18 g/mol
- Monoisotopic mass
- 204.04225873
Names & identifiers
- Preferred name
- 4-Hydroxy-8-methoxynaphthalene-1,2-dione
- IUPAC
- 4-hydroxy-8-methoxynaphthalene-1,2-dione
Names & synonyms
13261-50-24-hydroxy-8-methoxynaphthalene-1,2-dione2-hydroxy-8-methoxynaphthalene-1,4-dione1,4-Naphthalenedione, 2-hydroxy-8-methoxy-SCHEMBL91750212-hydroxy-8-methoxynaphthoquinoneDTXSID10356282SBB093267AQ-776/42801622
Database identifiers
- CAS
13261-50-2- PubChem CID
- 821111
- DTXSID
DTXSID10356282- Nikkaji
- J1.396.191C
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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