Trifluoroacetic acid → HCID 67376339, compound

HRID 2149610Notes

Reaction equation

HRID 2149610 reaction equation
[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:52][S:53]([Cl:54])(=[O:55])=[O:56].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH:8]1[CH2:9][CH2:10][CH:11]([NH:14][C:15](=[O:16])[N:17]2[CH:18]([c:37]3[c:38]([F:44])[c:39]([Cl:43])[cH:40][cH:41][cH:42]3)[C:19]3([C:20](=[O:29])[NH:21][c:22]4[cH:23][c:24]([Cl:28])[cH:25][cH:26][c:27]43)[CH:30]([CH2:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:31]2)[CH2:12][CH2:13]1>>[N:8]1([S:53]([CH3:52])(=[O:55])=[O:56])[CH2:9][CH2:10][CH:11]([NH:14][C:15](=[O:16])[N:17]2[CH:18]([c:37]3[c:38]([F:44])[c:39]([Cl:43])[cH:40][cH:41][cH:42]3)[C:19]3([C:20](=[O:29])[NH:21][c:22]4[cH:23][c:24]([Cl:28])[cH:25][cH:26][c:27]43)[CH:30]([CH2:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:31]2)[CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 6422Trifluoroacetic acidHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 76021590HCID 76021590, compound

Product 1

HCID 67376339HCID 67376339, compound

Sources & evidence

ORD record
ord-8929e8b49c3246809c263ce39d139815
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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