Dichloromethane → Trifluoroacetate

HRID 1551280Notes

Reaction equation

HRID 1551280 reaction equation
[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:12])[NH:13][CH:14]3[CH:15]([NH:23][C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]4[CH2:22]3)[nH:7][c:8]2[cH:9][cH:10]1.[Cl:38][CH2:39][Cl:40].[F:31][C:32]([C:33](=[O:34])[OH:35])([F:36])[F:37]>>[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:12])[NH:13][CH:14]3[CH:15]([NH2:23])[c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]4[CH2:22]3)[nH:7][c:8]2[cH:9][cH:10]1.[F:31][C:32]([C:33](=[O:34])[O-:35])([F:36])[F:37]

Participants

5

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 58742492tert-butyl N-[2-[(5-chloro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]carbamate

Product 2

HCID 84468TrifluoroacetateHCID 21883948Rac-n-(1-amino-2,3-dihydro-1h-inden-2-yl)-5-chloro-1h-indole-2-carboxamide

Sources & evidence

ORD record
ord-1c5baf41ad3d472e874566095217af14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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