Basic information
- CAS
14545-01-8- Standard SMILES
O=[N+]([O-])c1ccc(-n2ccnc2)c([N+](=O)[O-])c1- InChIKey
DDUTWQBMJHOFNK-UHFFFAOYSA-N- Molecular formula
- C9H6N4O4
- Average molar mass
- 234.17 g/mol
- Monoisotopic mass
- 234.03890469
Names & identifiers
- Preferred name
- Imidazole, 1-(2,4-dinitrophenyl)-
- IUPAC
- 1-(2,4-dinitrophenyl)imidazole
- English name
- 1-(2,4-dinitrophenyl)imidazole
- Molecular formula
- C9H6N4O4
- Molecular weight
- 234.17
Names & synonyms
Imidazole, 1-(2,4-dinitrophenyl)-14545-01-8NSC 226251DTXSID20163040RefChem:348831DTXCID00855311-(2,4-dinitrophenyl)imidazole1-(2,4-dinitrophenyl)-1H-imidazole1H-Imidazole,1-(2,4-dinitrophenyl)-84GSF96KWUNSC-226251NSC226251
Show more names
1-(2,4-Dinitro-phenyl)-1H-imidazole
UNII-84GSF96KWUSCHEMBL10786918N-(2,4-Dinitrophenyl)imidazoleimidazole, 1-(2,4-dinitro)phenyl-AKOS0010868961H-Imidazole, 1-(2,4-dinitrophenyl)-
Database identifiers
- CAS
14545-01-8- PubChem CID
- 99482
- DTXSID
DTXSID20163040- UNII
- 84GSF96KWU
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 313
Physicochemical properties
- FDA UNII
- 84 GSF96KWU · 84GSF96KWU
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
HONEST JOY HOLDINGS LIMITED[email protected]
PRINCETON[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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