HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1892454Generated: October 28, 2026
Water → 2,2-Difluoro-1,3-benzodioxole-5-acetonitrile
https://huagongshe.com/reaction/1892454
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | Sodium Cyanide | HCID 8929 | — |
| Reactant | tert-Butyl methyl ether | HCID 15413 | — |
| Reactant | 5-(Chloromethyl)-2,2-difluorobenzo[d][1,3]dioxole | HCID 21992809 | — |
| Solvent | Dimethyl Sulfoxide | HCID 679 | — |
| Product | 2,2-Difluoro-1,3-benzodioxole-5-acetonitrile | HCID 20311384 | 95% |
Reaction Steps
A solution of 5-chloromethyl-2,2-difluoro-1,3-benzodioxole (1 eq) in DMSO (1.25 vol) was added to a slurry of NaCN (1.4 eq) in DMSO (3 vol), while maintaining the temperature between 30 to 40° C. The mixture was stirred for 1 hour, and then water (6 vol) was added, followed by methyl tert-butyl ether (MTBE) (4 vol). After stirring for 30 minutes, the layers were separated. The aqueous layer was extracted with MTBE (1.8 vol). The combined organic layers were washed with water (1.8 vol), dried (Na2SO4), filtered, and concentrated to afford crude (2,2-difluoro-1,3-benzodioxol-5-yl)-acetonitrile (95%) that was used directly in the next step.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08507687B2 |
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| Source dataset | uspto-grants-2013_08 |
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| ORD ID | ord-5a8f732911774b9eb2466876feaebdaf |
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| Source note | uspto-grants-2013_08 |
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