HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Sodium Ion → 4-[3-[6-(3-Bromo-5-ethoxymethyl-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

HRID 1220748
Notes
Print preview

Reaction equation

HRID 1220748 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:31][CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][c:22]2[cH:23][c:24]([Br:30])[cH:25][c:26]([CH2:28][OH:29])[cH:27]2)[cH:12][cH:13][cH:14]1)=[O:38].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[H-:42].[I:39][CH2:40][CH3:41].[Na+:43].[OH2:49]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:31][CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][c:22]2[cH:23][c:24]([Br:30])[cH:25][c:26]([CH2:28][O:29][CH2:40][CH3:41])[cH:27]2)[cH:12][cH:13][cH:14]1)=[O:38]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 6340IodoethaneHCID 166653HydrideHCID 594968024-[3-[6-(3-Bromo-5-hydroxymethyl-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

Product 1

HCID 59496795
4-[3-[6-(3-Bromo-5-ethoxymethyl-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

Sources & evidence

ORD record
ord-2a0eaeb358c4423384e782f401a2ed8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes