Potassium Cation → [5-(1-Biphenyl-4-ylmethyl-6-chloro-5-iodo-1H-benzoimidazol-2-yloxy)-2-methyl-phenyl]-phosphonic acid diethyl ester

HRID 1571217Notes

Reaction equation

HRID 1571217 reaction equation
[CH2:35]([CH3:36])[O:37][P:38]([O:39][CH2:40][CH3:41])(=[O:42])[c:43]1[c:44]([CH3:50])[cH:45][cH:46][c:47]([OH:49])[cH:48]1.[K+:29].[K+:30].[O-:31][C:32]([O-:33])=[O:34].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[c:1]1(-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:2][cH:3][c:4]([CH2:7][n:8]2[c:9]([S:19]([CH3:20])(=[O:21])=[O:22])[n:10][c:11]3[c:12]2[cH:13][c:14]([Cl:18])[c:15]([I:17])[cH:16]3)[cH:5][cH:6]1>>[c:1]1(-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:2][cH:3][c:4]([CH2:7][n:8]2[c:9]([O:49][c:47]3[cH:46][cH:45][c:44]([CH3:50])[c:43]([P:38]([O:37][CH2:35][CH3:36])([O:39][CH2:40][CH3:41])=[O:42])[cH:48]3)[n:10][c:11]3[c:12]2[cH:13][c:14]([Cl:18])[c:15]([I:17])[cH:16]3)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 57481474Diethyl 5-hydroxy-2-methylphenylphosphonateHCID 673776421-Biphenyl-4-ylmethyl-6-chloro-5-iodo-2-methanesulfonyl-1H-benzoimidazole

Product 1

HCID 86761791[5-(1-Biphenyl-4-ylmethyl-6-chloro-5-iodo-1H-benzoimidazol-2-yloxy)-2-methyl-phenyl]-phosphonic acid diethyl ester

Sources & evidence

ORD record
ord-39b6f81906594042acfc959dd7758c0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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