Basic information
- CAS
52964-97-3- Standard SMILES
c1nc2cc3cn[nH]cc3cc2n1- InChIKey
SCYJJTCIUKFGBP-UHFFFAOYSA-N- Molecular formula
- C9H6N4
- Average molar mass
- 170.17 g/mol
- Monoisotopic mass
- 170.05924621
Names & identifiers
- Preferred name
- 1H-Imidazo[4,5-G]phthalazine
- IUPAC
- 7H-imidazo[4,5-g]phthalazine
- English name
- 1H-Imidazo[4,5-g]phthalazine(9CI)
- Molecular formula
- C9H6N4
- Molecular weight
- 170.17
Names & synonyms
1H-IMIDAZO[4,5-G]PHTHALAZINE52964-97-3DTXSID706635051H-Imidazo[4,5-g]phthalazine(9CI)
Database identifiers
- CAS
52964-97-3- PubChem CID
- 136238024
- DTXSID
DTXSID70663505
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 446
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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