114462-80-5
Product Name:
METHYL 1-(2,4-DICHLOROPHENYL)-5-(2-METHOXY-2-OXOETHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLATE
Formula:
C13H11Cl2N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 344.15 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 343.0126612 g/mol |
| Monoisotopic Mass | 343.0126612 g/mol |
| Topological Polar Surface Area | 83.3 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 426 |
| 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 |