1,2-Benzisothiazol-3(2H)-one, 2-(2-furanylcarbonyl)-, 1,1-dioxide
Basic information
- CAS
63633-79-4- Standard SMILES
O=C(c1ccco1)N1C(=O)c2ccccc2S1(=O)=O- InChIKey
CDEUGGREIZGBIX-UHFFFAOYSA-N- Molecular formula
- C12H7NO5S
- Average molar mass
- 277.25 g/mol
- Monoisotopic mass
- 277.0044935
Names & identifiers
- Preferred name
- 1,2-Benzisothiazol-3(2H)-one, 2-(2-furanylcarbonyl)-, 1,1-dioxide
- IUPAC
- 2-(furan-2-carbonyl)-1,1-dioxo-1,2-benzothiazol-3-one
Names & synonyms
63633-79-4DTXSID903405031,2-Benzisothiazol-3(2H)-one, 2-(2-furanylcarbonyl)-, 1,1-dioxideRefChem:215566DTXCID702915842-[2-Furoyl]benzisothiazolinone-1,1-dioxideSCHEMBL7287897CDEUGGREIZGBIX-UHFFFAOYSA-N2-(2-Furoyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide #2-(Furan-2-carbonyl)-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Database identifiers
- CAS
63633-79-4- PubChem CID
- 565317
- DTXSID
DTXSID90340503
Properties
Computed structural properties
- XLogP
- 1.4
- 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
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Compound notes
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