Bromide ion → 5-(Cyclopropyl-hydroxymethyl)-N-methyl-N-propyl-isophthalamic acid ethyl ester

HRID 116694Notes

Reaction equation

HRID 116694 reaction equation
[Br-:1].[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1.[CH2:6]([CH3:7])[O:8][C:9]([c:10]1[cH:11][c:12]([C:13](=[O:14])[N:15]([CH2:16][CH2:17][CH3:18])[CH3:19])[cH:20][c:21]([CH:23]=[O:24])[cH:22]1)=[O:25].[CH:2]1([Mg+:5])[CH2:3][CH2:4]1>>[CH:2]1([CH:23]([c:21]2[cH:20][c:12]([C:13](=[O:14])[N:15]([CH2:16][CH2:17][CH3:18])[CH3:19])[cH:11][c:10]([C:9]([O:8][CH2:6][CH3:7])=[O:25])[cH:22]2)[OH:24])[CH2:3][CH2:4]1

Participants

5

Reactant 4

HCID 259Bromide ionHCID 8028TetrahydrofuranHCID 86615013HCID 86615013, compoundHCID 178507030HCID 178507030, compound

Product 1

HCID 688170545-(Cyclopropyl-hydroxymethyl)-N-methyl-N-propyl-isophthalamic acid ethyl ester

Sources & evidence

ORD record
ord-0e197f1d3f564e97b27e3d5cb02624f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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