Water → (+/-)-2,4-Dichloro-5-(1-bromoethyl)-pyrimidine

Reaction equation

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

Participants

Reactant 6

HCID 962Water

HCID 3024Dibromomethane

HCID 8857Ethyl Acetate

HCID 24613Phosphorus oxybromide

HCID 81531Diisopropylethylamine

HCID 151416481-(2,4-Dichloropyrimidin-5-yl)ethan-1-ol

Product 1

HCID 21908975(+/-)-2,4-Dichloro-5-(1-bromoethyl)-pyrimidine

Sources & evidence

ORD record: ord-647b3ece5f3c4213bc882ffb1f09f891
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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