Basic information
- CAS
17644-94-9- Standard SMILES
O=c1c2ccccc2c(=O)n2n1C1C=CC2C1- InChIKey
JGOODLYRAYGMBT-UHFFFAOYSA-N- Molecular formula
- C13H10N2O2
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.07422757
Names & identifiers
- Preferred name
- 1,4-Methanopyridazino(1,2-b)phthalazine-6,11-dione, 1,4-dihydro-
- IUPAC
- 2,11-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene-3,10-dione
Names & synonyms
17644-94-9NSC 3551391,4-Methanopyridazino(1,2-b)phthalazine-6,11-dione, 1,4-dihydro-1,4-Methanopyridazino[1,2-b]phthalazine-6,11-dione, 1,4-dihydro-RefChem:220927NSC3551391,4-DIHYDRO-1,4-METHANOPYRIDAZINO[1,2-B]PHTHALAZINE-6,11-DIONENSC-3551392WUX4DD55TOprea1_129549SCHEMBL11375722DTXSID00938798
Show more names
AKOS004907727
Database identifiers
- CAS
17644-94-9- PubChem CID
- 337368
- DTXSID
DTXSID00938798- UNII
- 2WUX4DD55T
- Nikkaji
- J1.825.177I
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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