Ethanol → 4-[5-(4-Fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]butan-1-ol

HRID 115142Notes

Reaction equation

[CH2:10]([CH2:11][CH:12]=[CH2:13])[c:14]1[c:15]2[c:16]([n:17][cH:18][n:19]1)[s:20][cH:21][c:22]2-[c:23]1[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]1.[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:45][CH2:46][OH:47].[CH:1]12[CH2:2][CH2:3][CH2:4][CH:5]([BH:6]1)[CH2:7][CH2:8][CH2:9]2.[Na+:31].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH-:30].[OH:32][OH:33]>>[CH2:10]([CH2:11][CH2:12][CH2:13][OH:30])[c:14]1[c:15]2[c:16]([n:17][cH:18][n:19]1)[s:20][cH:21][c:22]2-[c:23]1[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]1

Participants

Reactant 8

HCID 702Ethanol

HCID 784Hydrogen Peroxide

HCID 923Sodium ion

HCID 961Hydroxide

HCID 8028Tetrahydrofuran

HCID 8857Ethyl Acetate

HCID 789669-Borabicyclo(3.3.1)nonane

HCID 116233584-But-3-en-1-yl-5-(4-fluorophenyl)thieno[2,3-d]pyrimidine

Product 1

HCID 115512134-[5-(4-Fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]butan-1-ol

Sources & evidence

ORD record: ord-4df37ba2369e42daadf3ca0a54ec576f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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