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

Water → S-1-methylethyl 3-(2'-chloro-4'-trifluoromethylphenoxy)-phenylthioacetate

HRID 1119583
Notes
Print preview

Reaction equation

HRID 1119583 reaction equation
[CH3:39][CH:40]([CH3:41])[SH:42].[CH:24]1([N:25]=[C:26]=[N:27][CH:28]2[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]2)[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]1.[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH2:11][C:12](=[O:13])[OH:14])[cH:8][cH:9][cH:10]2)[cH:15][cH:16][c:17]([C:19]([F:20])([F:21])[F:22])[cH:18]1.[Cl:43][CH2:44][Cl:45].[OH2:23]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH2:11][C:12](=[O:14])[S:42][CH:40]([CH3:39])[CH3:41])[cH:8][cH:9][cH:10]2)[cH:15][cH:16][c:17]([C:19]([F:20])([F:21])[F:22])[cH:18]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 63642-PropanethiolHCID 10868DicyclohexylcarbodiimideHCID 13607437{3-[2-Chloro-4-(trifluoromethyl)phenoxy]phenyl}acetic acid

Product 1

HCID 13607438S-1-methylethyl 3-(2'-chloro-4'-trifluoromethylphenoxy)-phenylthioacetate

Sources & evidence

ORD record
ord-defe45aee3204a84985b4183cb7bfd5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes