114462-77-0
Product Name:
METHYL 1-(4-CHLOROPHENYL)-5-(2-METHOXY-2-OXOETHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLATE
Formula:
C13H12ClN3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 309.70 g/mol |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 309.0516336 g/mol |
| Monoisotopic Mass | 309.0516336 g/mol |
| Topological Polar Surface Area | 83.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 388 |
| 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 |