N-[(Z)-(2-chloro-1-propylindol-3-yl)methylideneamino]-2,4-dinitroaniline
Basic information
- CAS
64209-17-2- Standard SMILES
CCCn1c(Cl)c(/C=N\Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc21- InChIKey
TYZNFLAECNTCLF-JAIQZWGSSA-N- Molecular formula
- C18H16ClN5O4
- Average molar mass
- 401.8 g/mol
- Monoisotopic mass
- 401.0890817
Names & identifiers
- Preferred name
- N-[(Z)-(2-chloro-1-propylindol-3-yl)methylideneamino]-2,4-dinitroaniline
- IUPAC
- N-[(Z)-(2-chloro-1-propylindol-3-yl)methylideneamino]-2,4-dinitroaniline
Names & synonyms
NSC26832564209-17-2NSC-268325
Database identifiers
- CAS
64209-17-2- PubChem CID
- 6058719
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 596
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…