Basic information
- Standard SMILES
CNS(=O)(=O)c1cc2c(c(C(=O)Cl)c1)OCCO2- InChIKey
RKSFKFSIQAQPHQ-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO5S
- Average molar mass
- 291.71 g/mol
Names & identifiers
- Preferred name
- 7-Methylsulfamoyl-1,4-benzodioxane-5-carbonyl chloride
- IUPAC
- 7-(methylsulfamoyl)-2,3-dihydro-1,4-benzodioxine-5-carbonyl chloride
Names & synonyms
SCHEMBL11264069RKSFKFSIQAQPHQ-UHFFFAOYSA-N7-methylsulfamoyl-1,4-benzodioxane-5-carbonyl chloride
Database identifiers
- PubChem CID
- 20544720
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 90.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 420
Related reactions
49 records
Compound notes
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