HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1966048Generated: October 27, 2026
Water → Tert-butyl 4-(2-chloro-5-nitrophenylsulfonyl)piperazine-1-carboxylate
https://huagongshe.com/reaction/1966048
Participants
| Role | Name | HCID | Charge |
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| Reactant | Water | HCID 962 | — |
| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | 2-Chloro-5-nitrobenzenesulfonyl chloride | HCID 20630 | — |
| Reactant | tert-Butyl piperazine-1-carboxylate | HCID 143452 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | Tert-butyl 4-(2-chloro-5-nitrophenylsulfonyl)piperazine-1-carboxylate | HCID 59260816 | 83.1% |
Reaction Steps
A solution of compound 37 (0.600 g, 2.34 mmol) in DCM (20.00 mL) was added tert-butyl 1-piperazinecarboxylate (0.566 g, 3.04 mmol) and TEA (0.422 mL, 3.04 mmol). The reaction was monitored with TLC (25% EtOAc in hexanes, Rf=0.53). The reaction mixture was complete after stirring at room temperature for 1 hr, as indicated by the absence of the starting material (TLC). Water was added and aqueous layer was extracted twice with DCM. Combined extracts were sequentially washed with water and brine, dried over MgSO4, filtered, and evaporated in vacuo to afford a yellow solid. The solid was triturated with DCM and hexanes, and then filtered to yield compound 38 as a yellow solid (0.789 g, 100% HPLC purity, 83% yield). 1H NMR (500 MHz, DMSO-d6): δ 8.60 (d, J=3 Hz, 1H), 8.47 (dd, J1=3 Hz, J2=8 Hz, 1H), 8.01 (d, J=8 Hz, 1H), 3.37 (m, 4H), 3.23 (m, 4H), 1.37 (s, 9H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08420639B2 |
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| Source dataset | uspto-grants-2013_04 |
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| ORD ID | ord-4f2acc1a304442419c61f72efc1f6d40 |
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| Source note | uspto-grants-2013_04 |
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