HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2046095Generated: October 27, 2026
Hydrochloric Acid → HCID 178458442, compound
https://huagongshe.com/reaction/2046095
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Hydroxylamine | HCID 787 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | 3-Iodo-4-isopropoxybenzonitrile | HCID 66615093 | — |
| Solvent | Ethanol | HCID 702 | — |
| Product | HCID 178458442 | HCID 178458442 | 95.3% |
Reaction Steps
A suspension of 3-iodo-4-isopropoxybenzonitrile (0.576 g; 2 mmol), HCl×NH2OH (0.276 g; 4 mmol) and DIPEA (0.69 ml; 4 mmol) in EtOH (50 ml) was stirred for 18 h at 50° C. The solvent was distilled off and the residue was diluted to 50 ml with EtOAc and washed with H2O. The organic layer was separated, dried over MgSO4 and filtered. The filtrate was distilled off to give the title product (0.61 g; 95%), as colourless solid. 1H-NMR (CDCl3) 8.0 (d, 1H, J=2.22 Hz); 7.55 (dd, 1H, J=9.54, 2.28 Hz); 6.77 (d, 1H, J=8.7 Hz); 4.95 (b, 2H); 4.69-4.63 (m, 1H); 1.42 (d, 6H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08592399B2 |
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| Source dataset | uspto-grants-2013_11 |
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| ORD ID | ord-f21b5cc15f204e6a94e0b8558ef26885 |
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| Source note | uspto-grants-2013_11 |
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