2,3-Dimethyl-3-phenyl-2,3-dihydro-1,2-benzisothiazole 1,1-dioxide
Basic information
- CAS
15448-90-5- Standard SMILES
CN1C(C)(c2ccccc2)c2ccccc2S1(=O)=O- InChIKey
BPSQPVMFPVVUKZ-UHFFFAOYSA-N- Molecular formula
- C15H15NO2S
- Average molar mass
- 273.4 g/mol
- Monoisotopic mass
- 273.08234989
Names & identifiers
- Preferred name
- 2,3-Dimethyl-3-phenyl-2,3-dihydro-1,2-benzisothiazole 1,1-dioxide
- IUPAC
- 2,3-dimethyl-3-phenyl-1,2-benzothiazole 1,1-dioxide
Names & synonyms
NSC10840815448-90-52,3-Dimethyl-3-phenyl-2,3-dihydro-1,2-benzisothiazole 1,1-dioxideNSC 1084082,3-dimethyl-3-phenyl-1,2-benzothiazole 1,1-dioxideNSC-1084081,2-Benzisothiazole, 2,3-dihydro-2,3-dimethyl-3-phenyl-, 1,1-dioxide
Database identifiers
- CAS
15448-90-5- PubChem CID
- 268255
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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