861210-49-3
Product Name:
DIMETHYL 1-[2-(METHOXYCARBONYL)-3-THIENYL]-1H-1,2,3-TRIAZOLE-4,5-DICARBOXYLATE
Formula:
C12H11N3O6S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 17.6 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 325.30 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 325.03685625 g/mol |
| Monoisotopic Mass | 325.03685625 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 462 |
| 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 |