2092929-97-8
Product Name:
Benzoic acid, 6-methyl-2-nitro-3-[(2,2,2-trifluoroacetyl)amino]-, methyl ester
Formula:
C11H9F3N2O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 306.19 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 306.04635588 g/mol |
| Monoisotopic Mass | 306.04635588 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 435 |
| 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 |