4-Hydroxy-3-nonylnaphthalene-1,2-dione
Basic information
- CAS
22799-68-4- Standard SMILES
CCCCCCCCCC1=C(O)c2ccccc2C(=O)C1=O- InChIKey
SLGDVSGIYBSSDY-UHFFFAOYSA-N- Molecular formula
- C19H24O3
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.17254462
Names & identifiers
- Preferred name
- 4-Hydroxy-3-nonylnaphthalene-1,2-dione
- IUPAC
- 4-hydroxy-3-nonylnaphthalene-1,2-dione
Names & synonyms
4-hydroxy-3-nonylnaphthalene-1,2-dione22799-68-4CHEMBL408346SCHEMBL9857129DTXSID30623024
Database identifiers
- CAS
22799-68-4- PubChem CID
- 22157752
- DTXSID
DTXSID30623024- ChEMBL
CHEMBL408346
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…