Water → HCID 66582331, compound

HRID 160192Notes

Reaction equation

HRID 160192 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][cH:13][c:14]([NH2:17])[n:15][cH:16]2)[cH:6][cH:7]1.[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][O:50][CH2:51][CH2:52][O:53][CH3:54].[Cl:40][CH2:41][Cl:42].[Cs+:47].[Cs+:48].[F:18][C:19]([C:20]([CH3:21])([OH:22])[c:23]1[cH:24][cH:25][c:26]([B:29]2[O:30][C:31]([CH3:32])([CH3:33])[C:34]([CH3:35])([CH3:36])[O:37]2)[cH:27][cH:28]1)([F:38])[F:39].[OH2:55]>>[c:2]1(-[c:26]2[cH:25][cH:24][c:23]([C:20]([C:19]([F:18])([F:38])[F:39])([CH3:21])[OH:22])[cH:28][cH:27]2)[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][cH:13][c:14]([NH2:17])[n:15][cH:16]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 58347286HCID 58347286, compoundHCID 66582681HCID 66582681, compound

Product 1

HCID 66582331HCID 66582331, compound

Sources & evidence

ORD record
ord-f1aee4fb9e764be9954fb0df48001052
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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