Benzene → 3-Benzylpyrrolylmethyl 3-(4-chlorophenoxy)-2,2-dimethylcyclopropanecarboxylate

HRID 1230859Notes

Reaction equation

HRID 1230859 reaction equation
[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[c:33]1[c:34]([CH2:38][OH:39])[nH:35][cH:36][cH:37]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]2[C:8]([CH3:13])([CH3:14])[CH:9]2[C:10](=[O:11])[OH:12])[cH:15][cH:16]1.[O:21]=[CH:22][N:23]([CH3:24])[CH3:25].[OH2:46].[S:17]([Cl:18])([Cl:19])=[O:20].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]2[C:8]([CH3:13])([CH3:14])[CH:9]2[C:10](=[O:11])[O:12][CH2:38][c:34]2[c:33]([CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:37][cH:36][nH:35]2)[cH:15][cH:16]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 962WaterHCID 6228DimethylformamideHCID 24386Thionyl ChlorideHCID 203049613-(4-Chlorophenoxy)-2,2-dimethylcyclopropanecarboxylic acidHCID 543430813-Benzyl-1-pyrrolylmethanol

Product 1

HCID 233351473-Benzylpyrrolylmethyl 3-(4-chlorophenoxy)-2,2-dimethylcyclopropanecarboxylate

Sources & evidence

ORD record
ord-07f023b69efe4a069f5a54269ec47bce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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