Trifluoroacetic acid → HCID 87130812, compound

HRID 2151866Notes

Reaction equation

HRID 2151866 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([NH:13][c:14]2[n:15][cH:16][c:17]([NH:20][C:21](=[O:22])[c:23]3[n:24][c:25](-[c:32]4[c:33]([O:38][C:39]([F:40])([F:41])[F:42])[cH:34][cH:35][cH:36][cH:37]4)[o:26][c:27]3[C:28]([F:29])([F:30])[F:31])[cH:18][cH:19]2)[CH2:11][CH2:12]1.[CH3:56][CH2:57][N:58]([CH2:59][CH3:60])[CH2:61][CH3:62].[Cl:50][C:51]([O:52][CH2:53][CH3:54])=[O:55].[OH:43][C:44]([C:45]([F:46])([F:47])[F:48])=[O:49]>>[CH2:1]([CH3:2])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([NH:13][c:14]2[n:15][cH:16][c:17]([NH:20][C:21](=[O:22])[c:23]3[n:24][c:25](-[c:32]4[c:33]([O:38][C:39]([F:40])([F:41])[F:42])[cH:34][cH:35][cH:36][cH:37]4)[o:26][c:27]3[C:28]([F:29])([F:30])[F:31])[cH:18][cH:19]2)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 6422Trifluoroacetic acidHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 87130798HCID 87130798, compound

Product 1

HCID 87130812HCID 87130812, compound

Sources & evidence

ORD record
ord-066c6dd05dc64dffa5e83afa9919c0ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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