13537-82-1
Product Name:
ETHYL 4-METHYL-2-CYCLOHEXANONE-1-CARBOXYLATE
Formula:
C10H16O3
Synonyms:
4-Methyl-2-oxocyclohexanecarboxylic acid ethyl ester;Ethyl 4-methyl-2-oxo-1-cyclohexanecarboxylate;NSC 84213
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COMPUTED DESCRIPTORS
| Molecular Weight | 184.23 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 184.109944368 g/mol |
| Monoisotopic Mass | 184.109944368 g/mol |
| Topological Polar Surface Area | 43.4 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 210 |
| 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 |