Water → HCID 25095385, compound

HRID 301369Notes

Reaction equation

HRID 301369 reaction equation
[C:38](=[O:39])([O-:40])[O-:41].[CH3:25][O:26][C:27]([CH2:28][CH2:29][c:30]1[cH:31][cH:32][c:33]([OH:36])[cH:34][cH:35]1)=[O:37].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[o:8][c:9](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1.[Cs+:42].[Cs+:43].[OH2:44]>>[c:2]1([O:36][c:33]2[cH:32][cH:31][c:30]([CH2:29][CH2:28][C:27]([O:26][CH3:25])=[O:37])[cH:35][cH:34]2)[c:3]2[c:4]([n:5][cH:6][n:7]1)[o:8][c:9](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1

Participants

6

Reactant 5

HCID 962WaterHCID 19660Carbonate IonHCID 79706Benzenepropanoic acid, 4-hydroxy-, methyl esterHCID 104967Cesium cation2×HCID 580168154-Chloro-5-(4-methoxyphenyl)-6-phenylfuro[2,3-d]pyrimidine

Product 1

HCID 25095385HCID 25095385, compound

Sources & evidence

ORD record
ord-cec74f6609f6480a8e68f5581cb22b6a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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