1210908-67-0
Product Name:
METHYL 5-CHLORO-2-([(E)-4,4,4-TRIFLUORO-1-METHYL-3-OXO-1-BUTENYL]AMINO)BENZENECARBOXYLATE
Formula:
C13H11ClF3NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 321.68 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 321.0379554 g/mol |
| Monoisotopic Mass | 321.0379554 g/mol |
| Topological Polar Surface Area | 55.4 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 437 |
| 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 |