Dichloromethane → Trifluoroacetic acid

HRID 315000Notes

Reaction equation

HRID 315000 reaction equation
[CH2:46]1[CH2:47][CH2:48][NH:49][CH2:50]1.[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[Cl:58][CH2:59][Cl:60].[Cl:8][c:9]1[cH:10][cH:11][c:12]([C:13](=[O:14])[N:15]2[CH2:16][C:17](=[O:43])[N:18]([CH2:29][c:30]3[cH:31][cH:32][c:33]([O:36][CH:37]4[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]4)[cH:34][cH:35]3)[c:19]3[c:20]([cH:22][cH:23][c:24]([C:26](=[O:27])[OH:28])[cH:25]3)[CH2:21]2)[cH:44][cH:45]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]>>[Cl:8][c:9]1[cH:10][cH:11][c:12]([C:13](=[O:14])[N:15]2[CH2:16][C:17](=[O:43])[N:18]([CH2:29][c:30]3[cH:31][cH:32][c:33]([O:36][CH:37]4[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]4)[cH:34][cH:35]3)[c:19]3[c:20]([cH:22][cH:23][c:24]([C:26](=[O:27])[N:49]4[CH2:48][CH2:47][CH2:46][CH2:50]4)[cH:25]3)[CH2:21]2)[cH:44][cH:45]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]

Participants

7

Reactant 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8471TriethylamineHCID 31268PyrrolidineHCID 22632433HCID 22632433, compound

Product 2

HCID 6422Trifluoroacetic acidHCID 22632596HCID 22632596, compound

Sources & evidence

ORD record
ord-cfb765bf49574aae86b1e7cc0de7d51a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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