1005252-41-4
Product Name:
2-TERT-BUTYL-7-CHLORO-2,3-DIHYDRO-1,2-BENZISOTHIAZOL-3-OL 1-OXIDE
Formula:
C11H14ClNO2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 259.75 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 259.0433776 g/mol |
| Monoisotopic Mass | 259.0433776 g/mol |
| Topological Polar Surface Area | 59.8 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 305 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |