Basic information
- Standard SMILES
O=C=NS(=O)(=O)c1ccccc1OC(F)F- InChIKey
BGVZDBCLXVQONI-UHFFFAOYSA-N- Molecular formula
- C8H5F2NO4S
- Average molar mass
- 249.19 g/mol
Names & identifiers
- Preferred name
- 2-Difluoromethoxybenzenesulfonylisocyanate
- IUPAC
- 2-(difluoromethoxy)-N-(oxomethylidene)benzenesulfonamide
Names & synonyms
2-difluoromethoxybenzenesulfonylisocyanateSCHEMBL7843852SCHEMBL313586422-difluoromethoxyphenyl-sulfonylisocyanate2-difluoromethoxyphenylsulfonyl isocyanate2-difluoromethoxyphenyl-sulfonyl isocyanate
Database identifiers
- PubChem CID
- 11096960
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 372
Related reactions
17 records
Compound notes
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