Basic information
- CAS
81-09-4- Standard SMILES
CCN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-]- InChIKey
NPJNXMOLTGZEHG-UHFFFAOYSA-N- Molecular formula
- C14H14N2O4S
- Average molar mass
- 306.34 g/mol
- Monoisotopic mass
- 306.06742811
Names & identifiers
- Preferred name
- N-Ethyl-2-nitro-N-phenylbenzenesulphonamide
- IUPAC
- N-ethyl-2-nitro-N-phenylbenzenesulfonamide
- English name
- N-ethyl-2-nitro-N-phenylbenzenesulphonamide
- Molecular formula
- C14H14N2O4S
- Molecular weight
- 306.34
Names & synonyms
N-ethyl-2-nitro-N-phenylbenzenesulfonamide81-09-4N-Ethyl-2-nitro-N-phenylbenzenesulphonamideN-ethyl-2-nitro-N-phenylbenzene-1-sulfonamideN-ethyl-2-nitrobenzenesulfonanilideEINECS 201-323-1starbld0004060Benzenesulfonamide, N-ethyl-2-nitro-N-phenyl-477MWL4M4FSCHEMBL6111591DTXSID70230837NPJNXMOLTGZEHG-UHFFFAOYSA-N
Show more names
N-Ethyl-o-nitrobenzenesulfonanilideSTK071957AKOS000671401ethyl[(2-nitrophenyl)sulfonyl]phenylamineNS00038107ST50694366
Database identifiers
- CAS
81-09-4- PubChem CID
- 66471
- DTXSID
DTXSID70230837- UNII
- 477MWL4M4F
- EC Number
- 201-323-1
- Nikkaji
- J30.746G
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 449
Physicochemical properties
- Boiling point
- 466.2 · 466.2±47.0 °C(Predicted)
- Density
- 1.358 · 1.358±0.06 g/cm3(Predicted)
- pka
- -3.31 · -3.31±0.50(Predicted)
Chemistry & industry
Suppliers2 total
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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