Trifluoroacetic acid → HCID 57555559, compound

HRID 173365Notes

Reaction equation

HRID 173365 reaction equation
[CH3:53][O:54][c:55]1[cH:56][cH:57][c:58]([C:61]2=[N:62][O:63][CH:64]3[CH:65]2[CH2:66][NH:67][CH2:68]3)[cH:59][n:60]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6]2=[N:13][O:12][CH:11]3[CH:7]2[CH2:8][N:9]([c:16]2[c:17]([F:38])[cH:18][c:19]4[c:20](=[O:37])[c:21]([C:34](=[O:35])[OH:36])[cH:22][n:23](-[c:26]5[c:27]([F:33])[cH:28][c:29]([F:32])[cH:30][cH:31]5)[c:24]4[n:25]2)[CH2:10]3)[cH:14][cH:15]1.[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45].[F:46][C:47]([F:48])([F:49])[C:50]([OH:51])=[O:52]>>[c:16]1([N:67]2[CH2:66][CH:65]3[C:61]([c:58]4[cH:57][cH:56][c:55]([O:54][CH3:53])[n:60][cH:59]4)=[N:62][O:63][CH:64]3[CH2:68]2)[c:17]([F:38])[cH:18][c:19]2[c:20](=[O:37])[c:21]([C:34](=[O:35])[OH:36])[cH:22][n:23](-[c:26]3[c:27]([F:33])[cH:28][c:29]([F:32])[cH:30][cH:31]3)[c:24]2[n:25]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acid2×HCID 25206945HCID 25206945, compoundHCID 57555546HCID 57555546, compound

Product 1

HCID 57555559HCID 57555559, compound

Sources & evidence

ORD record
ord-99b3427396a54507a3bd627705819bc5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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