2-(4-Bromophenyl)butanoic acid → HCID 67352171, compound

HRID 2348570Notes

Reaction equation

HRID 2348570 reaction equation
[Br:35][c:36]1[cH:37][cH:38][c:39]([CH:42]([C:43](=[O:44])[OH:45])[CH2:46][CH3:47])[cH:40][cH:41]1.[Cl:1][c:2]1[c:3]([CH:8]([CH3:9])[O:10][C:11]([NH:12][c:13]2[c:14]([CH3:33])[n:15][o:16][c:17]2-[c:18]2[cH:19][cH:20][c:21]([B:24]3[O:25][C:26]([CH3:27])([CH3:28])[C:29]([CH3:30])([CH3:31])[O:32]3)[cH:22][cH:23]2)=[O:34])[cH:4][cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[c:3]([CH:8]([CH3:9])[O:10][C:11]([NH:12][c:13]2[c:14]([CH3:33])[n:15][o:16][c:17]2-[c:18]2[cH:19][cH:20][c:21](-[c:36]3[cH:37][cH:38][c:39]([CH:42]([C:43](=[O:44])[OH:45])[CH2:46][CH3:47])[cH:40][cH:41]3)[cH:22][cH:23]2)=[O:34])[cH:4][cH:5][cH:6][cH:7]1

Participants

3

Reactant 2

HCID 574722-(4-Bromophenyl)butanoic acidHCID 67350448{3-Methyl-5-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-isoxazol-4-yl}-carbamic acid 1-(2-chloro-phenyl)-ethyl ester

Product 1

HCID 67352171HCID 67352171, compound

Sources & evidence

ORD record
ord-8ff4bb2ba4034e7ab1359d0253907349
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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