871927-70-7
Product Name:
1H-Indole-2-carboxylic acid, 5-[4-(trifluoromethyl)phenyl]-, ethyl ester
Formula:
C18H14F3NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 333.3 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 333.09766318 g/mol |
| Monoisotopic Mass | 333.09766318 g/mol |
| Topological Polar Surface Area | 42.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 446 |
| 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 |