63870-31-5
Product Name:
3-ETHYL-2-[3-(3-ETHYL-2-THIAZOLIDINYLIDENE)-1-PROPENYL]-5,6-DIMETHYL-BENZOXAZOLIUM IODIDE
Formula:
C23H25IN2OS
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COMPUTED DESCRIPTORS
Molecular Weight | 456.4 g/mol |
---|---|
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 456.07323 g/mol |
Monoisotopic Mass | 456.07323 g/mol |
Topological Polar Surface Area | 45.6 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 464 |
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 |