Basic information
- Standard SMILES
CC(C)(C)c1ccc2c(c1)C(=O)c1cc(C(C)(C)C)ccc1C2=O- InChIKey
GDNGHUJEIRASIR-UHFFFAOYSA-N- Molecular formula
- C22H24O2
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.17763
Names & identifiers
- Preferred name
- 2,7-Di-t-butylanthraquinone
- IUPAC
- 2,7-ditert-butylanthracene-9,10-dione
Names & synonyms
NSC6171502,7-di-t-butylanthraquinone2,7-di-t-butyl-anthraquinoneSCHEMBL13433263GDNGHUJEIRASIR-UHFFFAOYSA-NNSC-617150
Database identifiers
- PubChem CID
- 357626
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 475
Related reactions
2 records
Compound notes
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