1258649-56-7
Product Name:
Heptanoic acid, 5-oxo-4-(1-oxopropyl)-, ethyl ester
Formula:
C12H20O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 228.28 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 9 |
| Exact Mass | 228.13615911 g/mol |
| Monoisotopic Mass | 228.13615911 g/mol |
| Topological Polar Surface Area | 60.4 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 242 |
| 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 |