Water → 4,4-Difluoro-3-methyl-3-butenyl 2-(4-chlorobutoxy)-4-methylpyrimidine-5-carboxylate

Reaction equation

[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:7][S:8](=[O:9])(=[O:10])[c:11]1[n:12][cH:13][c:14]([C:18](=[O:19])[O:20][CH2:21][CH2:22][C:23](=[C:24]([F:25])[F:26])[CH3:27])[c:15]([CH3:17])[n:16]1.[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][OH:6].[OH2:35]>>[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:11]1[n:12][cH:13][c:14]([C:18](=[O:19])[O:20][CH2:21][CH2:22][C:23](=[C:24]([F:25])[F:26])[CH3:27])[c:15]([CH3:17])[n:16]1

Participants

Reactant 4

HCID 962Water

HCID 8471Triethylamine

HCID 135694-Chloro-1-butanol

HCID 691816824,4-Difluoro-3-methyl-3-butenyl 2-methanesulfonyl-4-methylpyrimidine-5-carboxylate

Product 1

HCID 230202154,4-Difluoro-3-methyl-3-butenyl 2-(4-chlorobutoxy)-4-methylpyrimidine-5-carboxylate

Sources & evidence

ORD record: ord-9c23d64926b4472399de9eb40105f373
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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