Water → HCID 20291281, compound

HRID 153966Notes

Reaction equation

HRID 153966 reaction equation
[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]1[CH2:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]21.[Cl:30][C:31]([C:32](=[O:33])[C:34]([Cl:35])([F:36])[F:37])([F:38])[F:39].[OH2:40]>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]1[CH2:15][CH2:16][c:17]2[cH:18][c:19]([C:32]([C:31]([Cl:30])([F:38])[F:39])([OH:33])[C:34]([Cl:35])([F:36])[F:37])[cH:20][cH:21][c:22]21

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 313762-Propanone, 1,3-dichloro-1,1,3,3-tetrafluoro-HCID 12151496HCID 12151496, compound

Product 1

HCID 20291281HCID 20291281, compound

Sources & evidence

ORD record
ord-ba0b841315d34fbbbf5a64f0604684c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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