338755-81-0
Product Name:
[4-OXO-3-(([3-(TRIFLUOROMETHYL)BENZOYL]OXY)METHYL)-3,4-DIHYDRO-2H-CHROMEN-3-YL]METHYL 3-(TRIFLUOROMETHYL)BENZENECARBOXYLATE
Formula:
C27H18F6O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 552.4 g/mol |
|---|---|
| XLogP3 | 6.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 8 |
| Exact Mass | 552.10075726 g/mol |
| Monoisotopic Mass | 552.10075726 g/mol |
| Topological Polar Surface Area | 78.9 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 852 |
| 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 |