HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1374083Generated: October 30, 2026
4-Toluenesulfonyl chloride → 3-(4-Cyanoanilino)propyl 4-methylbenzenesulfonate
https://huagongshe.com/reaction/1374083
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 4-Toluenesulfonyl chloride | HCID 7397 | — |
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | 4-((3-Hydroxypropyl)amino)benzonitrile | HCID 21867663 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | 3-(4-Cyanoanilino)propyl 4-methylbenzenesulfonate | HCID 21867652 | 77.2% |
Reaction Steps
A cooled (0° C.) solution of 4-[(3-hydroxypropyl)amino]benzonitrile (from step (i) above; 17 g, 96.5 mmol) in dry MeCN (195 mL) was treated with triethylamine (9.8 g, 96.5 mmol) and then p-toluenesulfonyl chloride (20.2 g, 106 mmol). The mixture was stirred at 0° C. for 90 minutes before being concentrated in vacuo. Water (200 mL) was added to the residue, and the aqueous solution was extracted with DCM. The organic phase was dried (Na2SO4), filtered and concentrated in vacuo. The resulting residue was purified by crystallisation from iso-propanol to yield 24.6 g (77%) of the sub-title compound.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07164017B2 |
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| Source dataset | uspto-grants-2007_01 |
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| ORD ID | ord-be508c8ac20143f980b5d144828f87f8 |
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| Source note | uspto-grants-2007_01 |
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