1H-Pyrazole-4,5-dione, 3-methyl-, 4-[2-[4-(2-phenyldiazenyl)phenyl]hydrazone]
Basic information
- CAS
365517-53-9- Standard SMILES
Cc1[nH][nH]c(=O)c1N=Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
BLTRZIPNLMBCAG-UHFFFAOYSA-N- Molecular formula
- C16H14N6O
- Average molar mass
- 306.32 g/mol
- Monoisotopic mass
- 306.12290909
Names & identifiers
- Preferred name
- 1H-Pyrazole-4,5-dione, 3-methyl-, 4-[2-[4-(2-phenyldiazenyl)phenyl]hydrazone]
- IUPAC
- 5-methyl-4-[(4-phenyldiazenylphenyl)diazenyl]-1,2-dihydropyrazol-3-one
Names & synonyms
DTXSID301038510AKOS003412213365517-53-91H-Pyrazole-4,5-dione, 3-methyl-, 4-[2-[4-(2-phenyldiazenyl)phenyl]hydrazone]
Database identifiers
- CAS
365517-53-9- PubChem CID
- 4632503
- DTXSID
DTXSID301038510
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 513
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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