477866-87-8
Product Name:
2-[(4-CHLOROPHENYL)SULFANYL]-5-(TRIFLUOROMETHYL)BENZENECARBONITRILE
Formula:
C14H7ClF3NS
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COMPUTED DESCRIPTORS
| Molecular Weight | 313.73 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 312.9939826 g/mol |
| Monoisotopic Mass | 312.9939826 g/mol |
| Topological Polar Surface Area | 49.1 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 370 |
| 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 |