Basic information
- CAS
29528-39-0- Standard SMILES
COc1cc(O)c2ccccc2c1O- InChIKey
VJYFJGGTGSOCAX-UHFFFAOYSA-N- Molecular formula
- C11H10O3
- Average molar mass
- 190.19 g/mol
- Monoisotopic mass
- 190.06299418
Names & identifiers
- Preferred name
- 2-Methoxynaphthalene-1,4-diol
- IUPAC
- 2-methoxynaphthalene-1,4-diol
Names & synonyms
2-Methoxynaphthalene-1,4-diol29528-39-0SCHEMBL9054405SCHEMBL29700325DTXSID10502686VJYFJGGTGSOCAX-UHFFFAOYSA-N2-methoxy-1,4-dihydroxynaphthalene
Database identifiers
- CAS
29528-39-0- PubChem CID
- 12563544
- DTXSID
DTXSID10502686- Nikkaji
- J2.893.411D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 195
Related reactions
2 records
Compound notes
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