N-(2-ethylphenyl)-3-nitrobenzenesulfonamide
Basic information
- CAS
6109-01-9- Standard SMILES
CCc1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1- InChIKey
LMDBVGLZYIQMBY-UHFFFAOYSA-N- Molecular formula
- C14H14N2O4S
- Average molar mass
- 306.34 g/mol
- Monoisotopic mass
- 306.06742811
Names & identifiers
- Preferred name
- N-(2-ethylphenyl)-3-nitrobenzenesulfonamide
- IUPAC
- N-(2-ethylphenyl)-3-nitrobenzenesulfonamide
Names & synonyms
N-(2-ethylphenyl)-3-nitrobenzenesulfonamide6109-01-9N-(2-ETHYLPHENYL)-3-NITRO-BENZENESULFONAMIDECBMicro_008201DTXSID00387303SMSF0014108STK008347AKOS000608496CB10766BIM-0008029.P001N-(2-Ethylphenyl)-3-nitrobenzene-1-sulfonamideAG-690/15431418
Database identifiers
- CAS
6109-01-9- PubChem CID
- 2886280
- DTXSID
DTXSID00387303
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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