DPPH radical
Basic information
- CAS
111051-84-4- Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(N=[N+](c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1- InChIKey
MGJZITXUQXWAKY-UHFFFAOYSA-N- Molecular formula
- C18H12N5O6+
- Average molar mass
- 394.3 g/mol
- Monoisotopic mass
- 394.07875812
Names & identifiers
- Preferred name
- DPPH radical
- IUPAC
- diphenyl-(2,4,6-trinitrophenyl)iminoazanium
Names & synonyms
DPPH radicalRefChem:590428111051-84-4SCHEMBL15437969SCHEMBL15437971DTXSID509119701,1-Diphenyl-2-(2,4,6-trinitrophenyl)diazen-1-ium
Database identifiers
- CAS
111051-84-4- PubChem CID
- 15911
- DTXSID
DTXSID50911970
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 1
- Complexity
- 599
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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