Chloride → HCID 58117491, compound

HRID 148371

Reaction equation

HRID 148371 reaction equation
[C:26](=[O:27])([O-:28])[OH:29].[CH3:34][CH2:35][OH:36].[Cl-:15].[Cl:16][c:17]1[cH:18][c:19]([C:23](=[O:24])[OH:25])[n:20][cH:21][n:22]1.[Cl:31][CH2:32][Cl:33].[F:1][C:2]([CH2:3][NH:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)([F:11])[F:12].[Na+:14].[Na+:30].[OH-:13]>>[F:1][C:2]([CH2:3][N:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[C:23]([c:19]1[cH:18][c:17]([Cl:16])[n:22][cH:21][n:20]1)=[O:24])([F:11])[F:12]

Participants

9

Reactant 8

HCID 312ChlorideHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 961HydroxideHCID 6344DichloromethaneHCID 9596Aniline, N-(2,2,2-trifluoroethyl)-HCID 166377476-Chloro-4-pyrimidinecarboxylic acid

Product 1

HCID 58117491HCID 58117491, compound

Sources & evidence

ORD record
ord-2158edf093924f088dcc031e618d2628
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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