477859-25-9
Product Name:
3-CHLORO-1-BENZOTHIOPHENE-2-CARBALDEHYDE O-(2-[3-(TRIFLUOROMETHYL)PHENOXY]ETHYL)OXIME
Formula:
C18H13ClF3NO2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 399.8 g/mol |
|---|---|
| XLogP3 | 6.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 399.0307620 g/mol |
| Monoisotopic Mass | 399.0307620 g/mol |
| Topological Polar Surface Area | 59.1 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 480 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |