Trifluoroacetic acid → HCID 178439703, compound

HRID 1130542Notes

Reaction equation

HRID 1130542 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:43])[c:6]([CH2:40][CH2:41][CH3:42])[c:7]([O:8][CH2:9][CH2:10][CH2:11][O:12][c:13]2[cH:14][c:15]([NH:21][C:22](=[O:23])[c:24]3[n:25][n:26][n:27][n:28]3[CH2:29][c:30]3[cH:31][cH:32][c:33]([O:34][CH3:35])[cH:36][cH:37]3)[c:16]([CH3:20])[cH:17][c:18]2[Br:19])[cH:38][cH:39]1.[CH3:51][O:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[OH:44][C:45]([C:46]([F:47])([F:48])[F:49])=[O:50]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:43])[c:6]([CH2:40][CH2:41][CH3:42])[c:7]([O:8][CH2:9][CH2:10][CH2:11][O:12][c:13]2[cH:14][c:15]([NH:21][C:22](=[O:23])[c:24]3[nH:25][n:26][n:27][n:28]3)[c:16]([CH3:20])[cH:17][c:18]2[Br:19])[cH:38][cH:39]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 7519AnisoleHCID 19851980HCID 19851980, compound

Product 1

HCID 178439703HCID 178439703, compound

Sources & evidence

ORD record
ord-4b439ac638f54aa08a00d8c00aae5001
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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