Basic information
- CAS
63460-11-7- Standard SMILES
Nc1ccc(Br)c2c1C(=O)c1ccc(O)cc1C2=O- InChIKey
BPQKBPUDKDXCLX-UHFFFAOYSA-N- Molecular formula
- C14H8BrNO3
- Average molar mass
- 318.12 g/mol
- Monoisotopic mass
- 316.96876
Names & identifiers
- Preferred name
- Aminobromohydroxy-9,10-anthracendione
- IUPAC
- 1-amino-4-bromo-6-hydroxyanthracene-9,10-dione
Names & synonyms
AMINOBROMOHYDROXY-9,10-ANTHRACENDIONE63460-11-71-amino-4-bromo-6-hydroxyanthracene-9,10-dioneDTXSID60212884
Database identifiers
- CAS
63460-11-7- PubChem CID
- 44538
- DTXSID
DTXSID60212884
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 80.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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