131505-53-8
Product Name:
2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-ethynylphenyl)-4-(2-methylcyclo propyl)-, trans-
Formula:
C17H18O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 270.32 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 270.125594432 g/mol |
| Monoisotopic Mass | 270.125594432 g/mol |
| Topological Polar Surface Area | 27.7 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 416 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |