Basic information
- CAS
27702-26-7- Standard SMILES
Ic1ccc(C=NNc2nnc(NN=Cc3ccc(I)cc3)c3ccccc23)cc1- InChIKey
UYZAVJCEVZYOMK-UHFFFAOYSA-N- Molecular formula
- C22H16I2N6
- Average molar mass
- 618.2 g/mol
- Monoisotopic mass
- 617.95259
Names & identifiers
- Preferred name
- 1-N,4-N-bis[(4-iodophenyl)methylideneamino]phthalazine-1,4-diamine
- IUPAC
- 1-N,4-N-bis[(4-iodophenyl)methylideneamino]phthalazine-1,4-diamine
Names & synonyms
27702-26-7DTXSID109503851,4-Bis{[(4-iodophenyl)methylidene]hydrazinylidene}-1,2,3,4-tetrahydrophthalazine
Database identifiers
- CAS
27702-26-7- PubChem CID
- 266367
- DTXSID
DTXSID10950385
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 522
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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