2-Butyl-1,4-dihydroxyanthracene-9,10-dione
Basic information
- CAS
23861-69-0- Standard SMILES
CCCCc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O- InChIKey
DOASJDOJWIEXEF-UHFFFAOYSA-N- Molecular formula
- C18H16O4
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.10485899
Names & identifiers
- Preferred name
- 2-Butyl-1,4-dihydroxyanthracene-9,10-dione
- IUPAC
- 2-butyl-1,4-dihydroxyanthracene-9,10-dione
Names & synonyms
NSC15337323861-69-02-butyl-1,4-dihydroxyanthracene-9,10-dioneDTXSID20329745NSC-153373
Database identifiers
- CAS
23861-69-0- PubChem CID
- 423407
- DTXSID
DTXSID20329745
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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