Benzene → Bromide ion

Reaction equation

[Br:20][CH2:21][CH:22]=[CH:23][CH:24]=[CH:25][C:26](=[O:27])[O:28][CH2:29][CH3:30].[c:1]1([P:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[Br-:20].[c:1]1([P+:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:21][CH:22]=[CH:23][CH:24]=[CH:25][C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

Reactant 3

HCID 241Benzene

HCID 11776Triphenylphosphine

HCID 54103448Ethyl 6-bromohexa-2,4-dienoate

Product 2

HCID 259Bromide ion

HCID 736763415-Ethoxycarbonylpenta-2,4-dienyltriphenylphosphorane

Sources & evidence

ORD record: ord-cb124ce995f747f58404a77e6b90f73e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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