303152-63-8
Product Name:
3-[4-NITRO-3-(TRIFLUOROMETHYL)PHENOXY]-2-THIOPHENECARBOXYLIC ACID
Formula:
C12H6F3NO5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 333.24 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 332.99187795 g/mol |
| Monoisotopic Mass | 332.99187795 g/mol |
| Topological Polar Surface Area | 121 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 442 |
| 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 |