Basic information
- CAS
79642-61-8- Standard SMILES
O=C(c1ccoc1)N1C(=O)c2ccccc2S1(=O)=O- InChIKey
VMKAVSBKFBAXTD-UHFFFAOYSA-N- Molecular formula
- C12H7NO5S
- Average molar mass
- 277.25 g/mol
- Monoisotopic mass
- 277.0044935
Names & identifiers
- Preferred name
- Furoyl saccharin
- IUPAC
- 2-(furan-3-carbonyl)-1,1-dioxo-1,2-benzothiazol-3-one
- English name
- furoyl saccharin
- Molecular weight
- 0
Names & synonyms
Furoyl saccharin79642-61-8DTXSID40229819RefChem:141849DTXCID401523102-(furan-3-carbonyl)-1,1-dioxo-1,2-benzothiazol-3-one1,2-Benzisothiazol-3(2H)-one, 2-(3-furanylcarbonyl)-, 1,1-dioxide2-(Furan-3-carbonyl)-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Database identifiers
- CAS
79642-61-8- PubChem CID
- 64792
- DTXSID
DTXSID40229819
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 93 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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