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

Acetate → 3-(5-(3-Chloro-2-fluorobenzyl)-2-fluoro-4-methoxyphenyl)-3-oxopropionic acid ethyl ester

HRID 126466
Notes
Print preview

Reaction equation

HRID 126466 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([C:6](=[O:7])[CH3:8])[C:9]([c:10]1[c:11]([F:27])[cH:12][c:13]([O:25][CH3:26])[c:14]([CH2:16][c:17]2[c:18]([F:24])[c:19]([Cl:23])[cH:20][cH:21][cH:22]2)[cH:15]1)=[O:28])=[O:29].[CH3:32][C:33](=[O:34])[O-:35].[CH3:36][CH2:37][OH:38].[Na+:31].[OH2:30]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][C:9]([c:10]1[c:11]([F:27])[cH:12][c:13]([O:25][CH3:26])[c:14]([CH2:16][c:17]2[c:18]([F:24])[c:19]([Cl:23])[cH:20][cH:21][cH:22]2)[cH:15]1)=[O:28])=[O:29]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 175AcetateHCID 702EthanolHCID 923Sodium IonHCID 962WaterHCID 575728702-(5-(3-Chloro-2-fluorobenzyl)-2-fluoro-4-methoxybenzoyl)-3-oxobutyric acid ethyl ester

Product 1

HCID 575728593-(5-(3-Chloro-2-fluorobenzyl)-2-fluoro-4-methoxyphenyl)-3-oxopropionic acid ethyl ester
On this pageParticipantsSources & evidenceReaction notes

Sources & evidence

ORD record
ord-78d521d5592047b4989ac7a9053d232d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…