Benzene → HCID 19004330, compound

HRID 2144932Notes

Reaction equation

HRID 2144932 reaction equation
[CH3:1][O:2][C:3]([C:4]([c:5]1[cH:6][c:7]([Cl:26])[c:8]([O:12][CH2:13][CH2:14][O:15][c:16]2[cH:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[cH:24][cH:25]2)[c:9]([Cl:11])[cH:10]1)=[O:27])=[O:28].[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[CH3:49][OH:50].[Na+:30].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH-:29].[OH2:56].[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[cH:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[O:2]=[C:3]([C:4]([c:5]1[cH:6][c:7]([Cl:26])[c:8]([O:12][CH2:13][CH2:14][O:15][c:16]2[cH:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[cH:24][cH:25]2)[c:9]([Cl:11])[cH:10]1)=[O:27])[OH:28]

Participants

9

Reactant 8

HCID 241Benzene2×HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8058HexaneHCID 53777040HCID 53777040, compound

Product 1

HCID 19004330HCID 19004330, compound

Sources & evidence

ORD record
ord-5c46e84a73ce4f76b68c69cf2bdfd951
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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