Basic information
- Standard SMILES
CN(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
RYJYRRXKKQRVQO-UHFFFAOYSA-N- Molecular formula
- C10H14N2O4S
- Average molar mass
- 258.3 g/mol
Names & identifiers
- Preferred name
- Dimethyl-[2-(4-nitro-benzenesulfonyl)-ethyl]-amine
- IUPAC
- N,N-dimethyl-2-(4-nitrophenyl)sulfonylethanamine
Names & synonyms
SCHEMBL3575305RYJYRRXKKQRVQO-UHFFFAOYSA-Ndimethyl-[2-(4-nitro-benzenesulfonyl)-ethyl]-amine
Database identifiers
- PubChem CID
- 68698682
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 347
Related reactions
4 records
Compound notes
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