Basic information
- CAS
838906-38-0- Standard SMILES
Cc1ccc(S(=O)(=O)NC2CC(=O)OC(=O)C2)cc1- InChIKey
ZCUPLPGLIXDPIR-UHFFFAOYSA-N- Molecular formula
- C12H13NO5S
- Average molar mass
- 283.3 g/mol
- Monoisotopic mass
- 283.05144369
Names & identifiers
- Preferred name
- N-(2,6-Dioxooxan-4-yl)-4-methylbenzene-1-sulfonamide
- IUPAC
- N-(2,6-dioxooxan-4-yl)-4-methylbenzenesulfonamide
Names & synonyms
838906-38-0N-(2,6-Dioxooxan-4-yl)-4-methylbenzene-1-sulfonamideDTXSID60834267
Database identifiers
- CAS
838906-38-0- PubChem CID
- 71414830
- DTXSID
DTXSID60834267- Nikkaji
- J2.135.482A
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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