141973-36-6
Product Name:
Octadecanoic acid, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester (9CI)
Formula:
C37H58O6
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Melting Point | 56 - 58 °C |
COMPUTED DESCRIPTORS
| Molecular Weight | 598.9 g/mol |
|---|---|
| XLogP3 | 11.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 24 |
| Exact Mass | 598.42333957 g/mol |
| Monoisotopic Mass | 598.42333957 g/mol |
| Topological Polar Surface Area | 78.9 Ų |
| Heavy Atom Count | 43 |
| Formal Charge | 0 |
| Complexity | 833 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |