Basic information
- CAS
67151-57-9- Standard SMILES
Cc1ccc([N+](=O)[O-])cc1N=[N+]([O-])c1cc([N+](=O)[O-])ccc1C- InChIKey
VYWCUBKLICQCGK-UHFFFAOYSA-N- Molecular formula
- C14H12N4O5
- Average molar mass
- 316.27 g/mol
- Monoisotopic mass
- 316.0807695
Names & identifiers
- Preferred name
- Bis(2-methyl-5-nitrophenyl)diazene 1-oxide
- IUPAC
- (2-methyl-5-nitrophenyl)-(2-methyl-5-nitrophenyl)imino-oxidoazanium
- English name
- 22DIMETHYL55DINITROAZOXYBENZENE
- Molecular formula
- C14H12N4O5
- Molecular weight
- 316.27
Names & synonyms
4,4'-Dinitro-2,2'-azoxytolueneBis(2-methyl-5-nitrophenyl)diazene 1-oxide2,2'-Dimethyl-5,5'-dinitroazoxybenzene67151-57-9CCRIS 4407Diazene, bis(2-methyl-5-nitrophenyl)-, 1-oxide(2-methyl-5-nitrophenyl)-(2-methyl-5-nitrophenyl)imino-oxidoazaniumDTXSID10103177022DIMETHYL55DINITROAZOXYBENZENEDiazene, 1,2-bis(2-methyl-5-nitrophenyl)-, 1-oxide
Database identifiers
- CAS
67151-57-9- PubChem CID
- 149405
- DTXSID
DTXSID101031770- Nikkaji
- J1.036.385C
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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