52078-66-7
Product Name:
5,6-DIMETHYL-2-(3-(5,6-DIMETHYL-3-ETHYL-2-BENZOXAZOLINYLIDENE)-1-PROPENYL)-3-ETHYL BENZOXAZOLIUM IODIDE
Formula:
C25H29IN2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 516.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 516.12738 g/mol |
| Monoisotopic Mass | 516.12738 g/mol |
| Topological Polar Surface Area | 29.5 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 580 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 2 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |