301308-96-3
Product Name:
Acetic acid, 2-[(1,2,3,4-tetrahydro-4-oxocyclopenta[c][1]benzopyran-7-yl)oxy]-, butyl ester
Formula:
C18H20O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 316.3 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 316.13107373 g/mol |
| Monoisotopic Mass | 316.13107373 g/mol |
| Topological Polar Surface Area | 61.8 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 496 |
| 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 |