60212-11-5
Product Name:
Thiocyanic acid, C,C'-(1-methyl-1-phenyl-1,2-ethanediyl) ester
Formula:
C11H10N2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 234.3 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 234.02854067 g/mol |
| Monoisotopic Mass | 234.02854067 g/mol |
| Topological Polar Surface Area | 98.2 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 292 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |