Hydroxide → HCID 178442141, compound

HRID 1114904Notes

Reaction equation

HRID 1114904 reaction equation
[Ba+2:51].[CH3:53][O:54][CH2:55][CH2:56][O:57][CH3:58].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[F:8][c:9]1[cH:10][c:11]([CH2:16][CH:17]([CH:18]([CH2:19][NH:20][CH2:21][c:22]2[c:23]([CH2:32][CH2:33][CH2:34][CH:35]=[CH2:36])[cH:24][cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]2)[OH:37])[NH:38][C:39](=[O:40])[O:41][CH2:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:12][c:13]([F:15])[cH:14]1.[OH-:50].[OH-:52].[OH2:49].[OH2:59]>>[F:8][c:9]1[cH:10][c:11]([CH2:16][CH:17]([CH:18]([CH2:19][NH:20][CH2:21][c:22]2[c:23]([CH2:32][CH2:33][CH2:34][CH:35]=[CH2:36])[cH:24][cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]2)[OH:37])[NH2:38])[cH:12][c:13]([F:15])[cH:14]1

Participants

7

Reactant 6

HCID 961Hydroxide2×HCID 962Water2×HCID 6422Trifluoroacetic acidHCID 80711,2-DimethoxyethaneHCID 104810Barium ionHCID 178442140HCID 178442140, compound

Product 1

HCID 178442141HCID 178442141, compound

Sources & evidence

ORD record
ord-5b8d4ec0e4814b5eacaff983de8a1068
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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