1689-98-1
Product Name:
Octanoic acid, 2,6-dichloro-4-cyanophenyl ester
Formula:
C15H17Cl2NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 314.2 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 313.0636342 g/mol |
| Monoisotopic Mass | 313.0636342 g/mol |
| Topological Polar Surface Area | 50.1 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 341 |
| 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 |