Bromide ion → 2-[(1H-indol-4-yl)-ethenyl]-phenol

HRID 111268Notes

Reaction equation

HRID 111268 reaction equation
[Br-:1].[C:45](=[O:46])([O-:47])[O-:48].[CH2:63]([Cl:64])[Cl:65].[CH3:56][CH2:57][CH2:58][CH2:59][CH2:60][CH3:61].[CH:34](=[O:35])[c:36]1[c:37]2[cH:38][cH:39][nH:40][c:41]2[cH:42][cH:43][cH:44]1.[K+:49].[K+:50].[Li:29][CH2:30][CH2:31][CH2:32][CH3:33].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH2:62].[OH:2][c:3]1[c:4]([CH2:5][P+:6]([c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26][cH:27][cH:28]1>>[OH:2][c:3]1[c:4]([CH:5]=[CH:34][c:36]2[c:37]3[cH:38][cH:39][nH:40][c:41]3[cH:42][cH:43][cH:44]2)[cH:25][cH:26][cH:27][cH:28]1

Participants

11

Reactant 10

HCID 259Bromide ionHCID 813Potassium Cation2×HCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8058HexaneHCID 19660Carbonate IonHCID 333703Indole-4-carboxaldehydeHCID 27241432-[(Bromo-tri(phenyl)phosphoranyl)methyl]phenolHCID 178418339Butyllithium

Product 1

HCID 541413862-[(1H-indol-4-yl)-ethenyl]-phenol

Sources & evidence

ORD record
ord-607cea3b27804e60993e7beb85b4026d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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