Water → Ethyl 3-[4-(1-imidazol-1-ylbutyl)phenyl]prop-2-enoate

HRID 112243Notes

Reaction equation

HRID 112243 reaction equation
[C:18](=[O:19])([O:20][CH2:21][CH3:22])[CH:23]=[P:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1.[OH2:43].[n:1]1([CH:6]([CH2:7][CH2:8][CH3:9])[c:10]2[cH:11][cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]2)[cH:2][n:3][cH:4][cH:5]1>>[n:1]1([CH:6]([CH2:7][CH2:8][CH3:9])[c:10]2[cH:11][cH:12][c:13]([CH:14]=[CH:23][C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:16][cH:17]2)[cH:2][n:3][cH:4][cH:5]1

Participants

5

Reactant 4

HCID 962WaterHCID 312751,4-DioxaneHCID 70670Acetic acid, 2-(triphenylphosphoranylidene)-, ethyl esterHCID 145143774-[1-(1-Imidazolyl)butyl]-benzaldehyde

Product 1

HCID 53685372Ethyl 3-[4-(1-imidazol-1-ylbutyl)phenyl]prop-2-enoate

Sources & evidence

ORD record
ord-aadf1a21e3ea40b999b243ac2c2cfdba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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