38658-82-1
Product Name:
6-(ACETYLOXY)-1,8,9,10,11,11-HEXACHLOROTRICYCLO[6.2.1.0(2,7)]UNDECA-2,4,6,9-TETRAEN-3-YL ACETATE
Formula:
C15H8Cl6O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 464.9 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 463.852425 g/mol |
| Monoisotopic Mass | 461.855375 g/mol |
| Topological Polar Surface Area | 52.6 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 625 |
| 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 |