Chloride → HCID 58387934, compound

HRID 1135151Notes

Reaction equation

HRID 1135151 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]2[cH:10][c:11]3[cH:12][cH:13][cH:14][n:15][c:16]3[cH:17][cH:18]2)[cH:19][cH:20][cH:21]1.[C:38](#[N:39])[CH3:40].[CH2:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[Mg+:35].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Cl-:27].[O:22]1[CH2:23][CH2:24][CH2:25][CH2:26]1.[OH2:36].[OH2:37].[OH:41][C:42]([C:43]([F:44])([F:45])[F:46])=[O:47]>>[c:2]1([CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:3][c:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]2[cH:10][c:11]3[cH:12][cH:13][cH:14][n:15][c:16]3[cH:17][cH:18]2)[cH:19][cH:20][cH:21]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 962Water2×HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 58875334HCID 58875334, compoundHCID 178507042HCID 178507042, compound

Product 1

HCID 58387934HCID 58387934, compound

Sources & evidence

ORD record
ord-1dd1659891954e689446f4baf04cf431
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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