N-[(E)-decan-2-ylideneamino]-2,4-dinitroaniline
Basic information
- CAS
2675-17-4- Standard SMILES
CCCCCCCC/C(C)=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
XSZFTKRYHWTMLO-GHRIWEEISA-N- Molecular formula
- C16H24N4O4
- Average molar mass
- 336.39 g/mol
- Monoisotopic mass
- 336.17975526
Names & identifiers
- Preferred name
- N-[(E)-decan-2-ylideneamino]-2,4-dinitroaniline
- IUPAC
- N-[(E)-decan-2-ylideneamino]-2,4-dinitroaniline
Names & synonyms
NSC-230194NSC230194
Database identifiers
- CAS
2675-17-4- PubChem CID
- 9604904
- Nikkaji
- J595.502E
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 431
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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