HuagongsheHuagongshe Chemistry Print Report · For research reference only
Phosphorus oxychloride → HCID 178506155, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Phosphorus oxychloride | HCID 24813 | — |
| Reactant | Lawesson's reagent | HCID 87949 | — |
| Reactant | 3-(4-(Trifluoromethyl)phenyl)propionic Acid | HCID 3588736 | — |
| Reactant | 1H-benzimidazole-5-carbohydrazide | HCID 16637119 | — |
| Product | HCID 178506155 | HCID 178506155 | — |
Reaction Steps
The compound was synthesized starting from 3-(4-trifluoromethylphenyl)propionic acid (219 mg; 1 mmol), benzimidazol-5-carbohydrazide (176 mg; 1 mmol), Lawesson's reagent (606 mg; 1.5 mmol) and POCl3 (0.137 ml; 1.5 mmol) as described in method 3; yield: 0.017 g (4.5%); MS m/z: 375.1 [M+H]+; 1H-NMR (DMSO d6, 400 MHz): δ 3.22 (t, 2H, 3J=7.5 Hz); 3.52 (t, 2H, 3J=7.5 Hz); 7.53-7.55 (m, 2H); 7.65-7.67 (m, 2H); 7.84 (d, 1H, 3J=8.7 Hz); 7.92 (dd, 1H, 4J=1.7 Hz, 3J=8.7 Hz); 8.22-8.23 (m, 1H); 8.93 (s, 1H); HPLC (METHOD [A]): rt 14.82 min (98.3%)
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09181233B2 |
| Source dataset | uspto-grants-2015_11 |
| ORD ID | ord-cd70888ee9da44a59a078a0d613af905 |
| Source note | uspto-grants-2015_11 |