HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 511287Generated: November 1, 2026
Hydrochloric Acid → Diethyl 3-chloro-4-aminobenzylphosphonate
https://huagongshe.com/reaction/511287
Participants
| Role | Name | HCID | Charge |
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| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Diethyl 3-chloro-4-nitrobenzylphosphonate | HCID 86654007 | — |
| Catalyst | Iron | HCID 23925 | — |
| Solvent | Ethanol | HCID 702 | — |
| Product | Diethyl 3-chloro-4-aminobenzylphosphonate | HCID 19077629 | — |
Reaction Steps
A solution of diethyl (3-chloro-4-nitrobenzyl)phosphonate (Compound 104C, 0.500 g, 1.62 mmol) in EtOH (10 mL) was charged with iron (0.454 g, 8.12 mmol) and heated to reflux. When the reaction mixture reached reflux, it was charged with 0.1 N aq HCl (0.500 mL, 0.0812 mmol) and stirred for 10 min. The reaction mixture was filtered through a pad of celite and the filtrate was concentrated in vacuo. The compound was purified on an Isco Combiflash eluting with 40 to 90% EtOAc in heptane to afford the title compound. 1H NMR (400 MHz, chloroform-d) δ 7.19 (t, J=2.40 Hz, 1H), 7.01 (td, J=2.27, 8.08 Hz, 1H), 6.71 (dd, J=0.63, 8.21 Hz, 1H), 3.96-4.08 (m, 4H), 2.96-3.06 (m, 2H), 1.26 (t, J=7.07 Hz, 6H); MS (ES+): m/z: 278.0633 [MH+]. HPLC: tR=1.18 min (UPLC TOF MS: polar—3 min).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09096624B2 |
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| Source dataset | uspto-grants-2015_08 |
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| ORD ID | ord-ea0b68b629474c56955daffc376f88d0 |
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| Source note | uspto-grants-2015_08 |
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