Dichloromethane → Trifluoroacetic acid

HRID 126516Notes

Reaction equation

HRID 126516 reaction equation
[Cl:38][CH2:39][Cl:40].[F:1][C:2]([c:3]1[cH:4][c:5]2[c:6]([NH:13][CH2:14][C:15](=[O:16])[NH:17][CH:18]3[CH2:19][N:20]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH2:21]3)[n:7][cH:8][n:9][c:10]2[cH:11][cH:12]1)([F:29])[F:30].[F:31][C:32]([C:33](=[O:34])[OH:35])([F:36])[F:37]>>[F:1][C:2]([c:3]1[cH:4][c:5]2[c:6]([NH:13][CH2:14][C:15](=[O:16])[NH:17][CH:18]3[CH2:19][NH:20][CH2:21]3)[n:7][cH:8][n:9][c:10]2[cH:11][cH:12]1)([F:29])[F:30].[F:31][C:32]([C:33](=[O:34])[OH:35])([F:36])[F:37]

Participants

5

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 58562886Tert-butyl 3-(2-(6-(trifluoromethyl)quinazolin-4-ylamino)acetamido)azetidine-1-carboxylate

Product 2

HCID 6422Trifluoroacetic acidHCID 68003594N-(azetidin-3-yl)-2((6-(trifluoromethyl)quinazolin-4-yl)amino)acetamide

Sources & evidence

ORD record
ord-39a1794c01f14b18a2516d64c12dffba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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