2-(2,4-Dinitrophenyl)-3-methyl-2h-azirene
Basic information
- CAS
6274-61-9- Standard SMILES
CC1=NC1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
PYJODOKGZLMNFM-UHFFFAOYSA-N- Molecular formula
- C9H7N3O4
- Average molar mass
- 221.17 g/mol
- Monoisotopic mass
- 221.04365571
Names & identifiers
- Preferred name
- 2-(2,4-Dinitrophenyl)-3-methyl-2h-azirene
- IUPAC
- 2-(2,4-dinitrophenyl)-3-methyl-2H-azirine
Names & synonyms
6274-61-92-(2,4-dinitrophenyl)-3-methyl-2H-azirine2-(2,4-dinitrophenyl)-3-methyl-2h-azireneNSC37484DTXSID90284498NSC-37484
Database identifiers
- CAS
6274-61-9- PubChem CID
- 235754
- DTXSID
DTXSID90284498
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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