4-Amino-3-nitro-2,6-dimethylaniline
Basic information
- CAS
97629-64-6- Standard SMILES
Cc1cc(N)c([N+](=O)[O-])c(C)c1N- InChIKey
NXFZKAWSZHWLSZ-UHFFFAOYSA-N- Molecular formula
- C8H11N3O2
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.0851266
Names & identifiers
- Preferred name
- 4-Amino-3-nitro-2,6-dimethylaniline
- IUPAC
- 3,5-dimethyl-2-nitrobenzene-1,4-diamine
- English name
- 4-Amino-3-nitro-2,6-dimethylaniline
- Molecular formula
- C8H11N3O2
- Molecular weight
- 0
Names & synonyms
4-Amino-3-nitro-2,6-dimethylaniline97629-64-63,5-dimethyl-2-nitrobenzene-1,4-diamineCCRIS 8128SCHEMBL6156643DTXSID70243068AKOS006278046
Database identifiers
- CAS
97629-64-6- PubChem CID
- 5488258
- DTXSID
DTXSID70243068- Nikkaji
- J579.789F
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 204
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…