Basic information
- Standard SMILES
CNc1c([N+](=O)[O-])cc(C(C)(C)C)cc1[N+](=O)[O-]- InChIKey
SDESEGYLPHQNFO-UHFFFAOYSA-N- Molecular formula
- C11H15N3O4
- Average molar mass
- 253.25 g/mol
Names & identifiers
- Preferred name
- 4-tert-Butyl-N-methyl-2,6-dinitroaniline
- IUPAC
- 4-tert-butyl-N-methyl-2,6-dinitroaniline
Names & synonyms
4-tert-Butyl-N-methyl-2,6-dinitroaniline33629-43-5Aniline, 4-tert-butyl-N-methyl-2,6-dinitro-SCHEMBL11573663Benzenamine, 4-(1,1-dimethylethyl)-N-methyl-2,6-dinitro-N-methyl-2,6-dinitro-4-t-butylanilineN-(4-tert-Butyl-2,6-dinitrophenyl)-N-methylamine
Database identifiers
- PubChem CID
- 617279
- Nikkaji
- J113.304G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 305
Related reactions
4 records
Compound notes
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