N-Benzyl-5-methyl-2,4-dinitroaniline
Basic information
- CAS
67419-82-3- Standard SMILES
Cc1cc(NCc2ccccc2)c([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
MZSTVLNWCMBQOR-UHFFFAOYSA-N- Molecular formula
- C14H13N3O4
- Average molar mass
- 287.27 g/mol
- Monoisotopic mass
- 287.0906059
Names & identifiers
- Preferred name
- N-Benzyl-5-methyl-2,4-dinitroaniline
- IUPAC
- N-benzyl-5-methyl-2,4-dinitroaniline
Names & synonyms
N-Benzyl-5-methyl-2,4-dinitroaniline67419-82-3DTXSID50497603
Database identifiers
- CAS
67419-82-3- PubChem CID
- 12423979
- DTXSID
DTXSID50497603
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 373
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…