Basic information
- Standard SMILES
CN(C)CCNS(=O)(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1- InChIKey
SJEHRHWYZFYLOE-UHFFFAOYSA-N- Molecular formula
- C10H14N4O6S
- Average molar mass
- 318.31 g/mol
- Monoisotopic mass
- 318.06340535
Names & identifiers
- Preferred name
- N-[2-(dimethylamino)ethyl]-3,5-dinitrobenzenesulfonamide
- IUPAC
- N-[2-(dimethylamino)ethyl]-3,5-dinitrobenzenesulfonamide
Database identifiers
- PubChem CID
- 14723796
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 455
Related reactions
1 records
Compound notes
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