54594-85-3
Product Name:
5-Heptenoic acid, 7-(3-hydroxy-5-oxo-1-cyclopenten-1-yl)-, Methyl ester, (5Z)-
Formula:
C13H18O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 238.28 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 238.12050905 g/mol |
| Monoisotopic Mass | 238.12050905 g/mol |
| Topological Polar Surface Area | 63.6 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 341 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |