Basic information
- CAS
2873-62-3- Standard SMILES
CNc1cc(NC)c([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
QLZNUFFXTZBJBB-UHFFFAOYSA-N- Molecular formula
- C8H10N4O4
- Average molar mass
- 226.19 g/mol
- Monoisotopic mass
- 226.07020481
Names & identifiers
- Preferred name
- Methyl[5-(methylamino)-2,4-dinitrophenyl]amine
- IUPAC
- 1-N,3-N-dimethyl-4,6-dinitrobenzene-1,3-diamine
Names & synonyms
2873-62-3NSC133394SCHEMBL10981845DTXSID40951385AKOS024353654NSC-133394ST50979843methyl[5-(methylamino)-2,4-dinitrophenyl]amineN~1~,N~3~-Dimethyl-4,6-dinitrobenzene-1,3-diamine
Database identifiers
- CAS
2873-62-3- PubChem CID
- 280970
- DTXSID
DTXSID40951385- Nikkaji
- J668.840C
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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