Potassium Cation → Dimethyl 5-bentyloxy-isophthalate

HRID 176509Notes

Reaction equation

HRID 176509 reaction equation
[Br:16][CH2:17][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1.[C:24](=[O:25])([O-:26])[O-:27].[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[CH3:36][CH2:37][O:38][CH2:39][CH3:40].[K+:28].[K+:29].[OH2:30].[OH:1][c:2]1[cH:3][c:4]([C:12](=[O:13])[O:14][CH3:15])[cH:5][c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11]1>>[O:1]([c:2]1[cH:3][c:4]([C:12](=[O:13])[O:14][CH3:15])[cH:5][c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11]1)[CH2:17][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 7498Benzyl BromideHCID 19660Carbonate IonHCID 830651,3-Benzenedicarboxylic acid, 5-hydroxy-, 1,3-dimethyl ester

Product 1

HCID 7643390Dimethyl 5-bentyloxy-isophthalate

Sources & evidence

ORD record
ord-52f62ac218924d37af8cc18932503a66
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…