74802-04-3
Product Name:
7-Dimethylamino-4-methylcoumarin-3-isothiocyanate(DACITC)
Formula:
C13H12N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 260.31 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 260.06194880 g/mol |
| Monoisotopic Mass | 260.06194880 g/mol |
| Topological Polar Surface Area | 74 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 438 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |