Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(N2CCCS2(=O)=O)cc1- InChIKey
FPTDCFYGXIACIV-UHFFFAOYSA-N- Molecular formula
- C9H10N2O4S
- Average molar mass
- 242.25 g/mol
Names & identifiers
- Preferred name
- 2-(4-Nitrophenyl)isothiazolidine 1,1-dioxide
- IUPAC
- 2-(4-nitrophenyl)-1,2-thiazolidine 1,1-dioxide
Names & synonyms
2-(4-nitrophenyl)isothiazolidine 1,1-dioxideSCHEMBL5353846FPTDCFYGXIACIV-UHFFFAOYSA-N90868-48-7
Database identifiers
- PubChem CID
- 18446830
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 362
Related reactions
4 records
Compound notes
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