900019-64-9
Product Name:
DIMETHYL 2-[2-NITRO-5-(TRIFLUOROMETHYL)PHENYL]-2-(2-PROPYNYL)MALONATE
Formula:
C15H12F3NO6
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COMPUTED DESCRIPTORS
| Molecular Weight | 359.25 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 359.06167159 g/mol |
| Monoisotopic Mass | 359.06167159 g/mol |
| Topological Polar Surface Area | 98.4 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 572 |
| 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 |