Basic information
- CAS
16773-16-3- Standard SMILES
O=[N+]([O-])c1ccc(NCCNc2ccccc2)c([N+](=O)[O-])c1- InChIKey
RDCBHJAMDYEGGL-UHFFFAOYSA-N- Molecular formula
- C14H14N4O4
- Average molar mass
- 302.29 g/mol
- Monoisotopic mass
- 302.10150494
Names & identifiers
- Preferred name
- N~1~-(2,4-Dinitrophenyl)-N~2~-phenylethane-1,2-diamine
- IUPAC
- N'-(2,4-dinitrophenyl)-N-phenylethane-1,2-diamine
Names & synonyms
16773-16-3NSC149024DTXSID40937381N~1~-(2,4-Dinitrophenyl)-N~2~-phenylethane-1,2-diamineNSC-149024
Database identifiers
- CAS
16773-16-3- PubChem CID
- 288265
- DTXSID
DTXSID40937381
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…