1,4-Dioxane → Tert-butyl 3-(1-amino-2,2,2-trifluoroethyl)-5-(5-methylpyridin-2-yl)benzoate

HRID 1222252Notes

Reaction equation

HRID 1222252 reaction equation
[Br:21][Zn:22][c:23]1[n:24][cH:25][c:26]([CH3:29])[cH:27][cH:28]1.[NH2:1][CH:2]([C:3]([F:4])([F:5])[F:6])[c:7]1[cH:8][c:9]([C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[cH:17][c:18]([Br:20])[cH:19]1.[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1>>[NH2:1][CH:2]([C:3]([F:4])([F:5])[F:6])[c:7]1[cH:8][c:9]([C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[cH:17][c:18](-[c:23]2[n:24][cH:25][c:26]([CH3:29])[cH:27][cH:28]2)[cH:19]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 59539695Tert-butyl 3-(1-amino-2,2,2-trifluoroethyl)-5-bromobenzoateHCID 178427803HCID 178427803, compound

Product 1

HCID 68496539Tert-butyl 3-(1-amino-2,2,2-trifluoroethyl)-5-(5-methylpyridin-2-yl)benzoate

Sources & evidence

ORD record
ord-e38127c105aa435faf496749f0a8db82
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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