100916-78-7
Product Name:
Diethyl(2-hydroxyethyl)methylammonium bromide alpha-cyclohexyl-1-hydro xycyclohexaneacetate
Formula:
C21H40NO3.Br
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 434.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 9 |
| Exact Mass | 433.21916 g/mol |
| Monoisotopic Mass | 433.21916 g/mol |
| Topological Polar Surface Area | 46.5 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 407 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |