110704-21-7
Product Name:
Benzothiazole, 2-(chloromethyl)-4-fluoro- (9CI)
Formula:
C8H5ClFNS
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COMPUTED DESCRIPTORS
| Molecular Weight | 201.65 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 200.9815262 g/mol |
| Monoisotopic Mass | 200.9815262 g/mol |
| Topological Polar Surface Area | 41.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 169 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |