116492-99-0
Product Name:
4-CYANO-5-(METHYLTHIO)-3-[3-(TRIFLUOROMETHYL)PHENYL]THIOPHENE-2-CARBOXYLIC ACID
Formula:
C14H8F3NO2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 343.3 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 342.99485533 g/mol |
| Monoisotopic Mass | 342.99485533 g/mol |
| Topological Polar Surface Area | 115 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 476 |
| 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 |