HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,2-Dichloroethane → HCID 178509941, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 1,2-Dichloroethane | HCID 11 | — |
| Reactant | 1-Hydroxybenzotriazole | HCID 75771 | — |
| Reactant | 3-{[3-(Aminomethyl)-6-chloro-2-fluorophenyl]oxy}-5-chlorobenzonitrile | HCID 59451392 | — |
| Reactant | HCID 178524907 | HCID 178524907 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178509941 | HCID 178509941 | 39.1% |
Reaction Steps
The title compound was prepared in a similar manner to that described herein using EDC (0.068 g, 0.354 mmol), HOBT (0.048 g, 0.354 mmol), 3-{[3-(aminomethyl)-6-chloro-2-fluorophenyl]oxy}-5-chlorobenzonitrile (0.100 g, 0.321 mmol) and 1H-1,2,4-triazole-3-carboxylic acid (0.036 g, 0.321 mmol) in DMF (2 mL) to give title compound (0.051 g, 39%) as a white solid. 1H NMR (400 MHz, DMSO-d6) (95° C.) δ ppm 14.24 (br. s., 1H), 8.60 (br. s., 1H), 7.72 (s, 1H), 7.33-7.49 (m, 5H), 4.55 (d, 2H). ES MS: m/z 406 (M+1).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08304419B2 |
| Source dataset | uspto-grants-2012_11 |
| ORD ID | ord-138676578efb4b6f99e7a9c33dc1b5fe |
| Source note | uspto-grants-2012_11 |