Acetate → HCID 68924248, compound

HRID 2129319Notes

Reaction equation

HRID 2129319 reaction equation
[BrH:1].[C:45]([CH3:46])(=[O:47])[OH:48].[C:52]([O-:53])(=[O:54])[CH3:55].[C:57]([O-:58])(=[O:59])[CH3:60].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:28][c:29]1[cH:30][cH:31][c:32]([B:35]([OH:36])[OH:37])[cH:33][cH:34]1.[Cl:49][CH2:50][Cl:51].[Cu+2:56].[NH2:2][CH:3]1[CH2:4][CH:5]([CH3:27])[N:6]([C:13](=[O:14])[c:15]2[cH:16][c:17]3[cH:18][n:19][n:20]([CH:24]([CH3:25])[CH3:26])[c:21]3[cH:22][cH:23]2)[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]21.[cH:61]1[cH:62][cH:63][n:64][cH:65][cH:66]1>>[N:2]([CH:3]1[CH2:4][CH:5]([CH3:27])[N:6]([C:13](=[O:14])[c:15]2[cH:16][c:17]3[cH:18][n:19][n:20]([CH:24]([CH3:25])[CH3:26])[c:21]3[cH:22][cH:23]2)[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]21)([c:32]1[cH:31][cH:30][c:29]([Cl:28])[cH:34][cH:33]1)[C:45]([CH3:46])=[O:47]

Participants

10

Reactant 9

HCID 175Acetate2×HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 1049PyridineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 27099Cupric cationHCID 742994-Chlorophenylboronic acidHCID 68925264HCID 68925264, compound

Product 1

HCID 68924248HCID 68924248, compound

Sources & evidence

ORD record
ord-e64f42d7840a431e8b697d1910c2bbe5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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