400878-21-9
Product Name:
3-METHOXY-3-OXO-1-PROPENYL 4-(TRIFLUOROMETHYL)BENZENECARBOXYLATE
Formula:
C12H9F3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 274.19 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 274.04529325 g/mol |
| Monoisotopic Mass | 274.04529325 g/mol |
| Topological Polar Surface Area | 52.6 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 355 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |