Basic information
- Standard SMILES
O=C1OC(=O)c2cc3cnccc3c3cccc1c23- InChIKey
WHBUSRFNZWBWOU-UHFFFAOYSA-N- Molecular formula
- C15H7NO3
- Average molar mass
- 249.22 g/mol
- Monoisotopic mass
- 249.04259309
Names & identifiers
- Preferred name
- 7-Azaphenanthrene-1,10-dicarboxylic Anhydride
- IUPAC
- 11-oxa-5-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,3,5,7,9(17),13,15-heptaene-10,12-dione
Names & synonyms
SCHEMBL9041055WHBUSRFNZWBWOU-UHFFFAOYSA-N7-Azaphenanthrene-1,10-dicarboxylic Anhydride
Database identifiers
- PubChem CID
- 54430419
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 422
Related reactions
1 records
Linked notes
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