Water → HCID 15180851, compound

HRID 1567333Notes

Reaction equation

HRID 1567333 reaction equation
[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[F:10][c:11]1[cH:12][c:13](-[c:18]2[cH:19][cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25]2)[cH:14][cH:15][c:16]1[F:17].[F:1][CH2:2][CH2:3][CH2:4][CH:5]([CH2:6][OH:7])[CH2:8][OH:9].[OH2:44].[c:26]1([CH3:27])[cH:28][cH:29][c:30]([S:31]([OH:32])(=[O:33])=[O:34])[cH:35][cH:36]1>>[F:1][CH2:2][CH2:3][CH2:4][CH:5]1[CH2:6][O:7][CH:22]([c:21]2[cH:20][cH:19][c:18](-[c:13]3[cH:12][c:11]([F:10])[c:16]([F:17])[cH:15][cH:14]3)[cH:25][cH:24]2)[O:9][CH2:8]1

Participants

6

Reactant 5

HCID 962WaterHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 149852082-(3-Fluoropropyl)propane-1,3-diolHCID 151808503',4'-Difluoro[1,1'-biphenyl]-4-carbaldehyde

Product 1

HCID 15180851HCID 15180851, compound

Sources & evidence

ORD record
ord-6f03b85b13d544079c3865630dd79bee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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