867330-06-1
Product Name:
ETHYL (4-CYCLOHEXYL-5-MERCAPTO-4H-1,2,4-TRIAZOL-3-YL)ACETATE
Formula:
C12H19N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 269.37 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 269.11979803 g/mol |
| Monoisotopic Mass | 269.11979803 g/mol |
| Topological Polar Surface Area | 86 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 364 |
| 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 |