64661-04-7
Product Name:
Hexanedioic acid, 2,5-dicyano-, 1,6-diethyl ester
Formula:
C12H16N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 252.27 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 9 |
| Exact Mass | 252.11100700 g/mol |
| Monoisotopic Mass | 252.11100700 g/mol |
| Topological Polar Surface Area | 100 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 349 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |