Ethyl Bromide → HCID 178463697, compound

HRID 700803Notes

Reaction equation

HRID 700803 reaction equation
[Br:46][CH2:47][CH3:48].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[CH:37]([CH3:38])([N:39]([CH:40]([CH3:41])[CH3:42])[CH2:43][CH3:44])[CH3:45].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][c:8]2[cH:9][c:10]3[c:14]([cH:15][cH:16]2)[NH:13][N:12]([CH:17]([C:18]([CH2:19][n:20]2[n:21][cH:22][n:23][cH:24]2)([OH:25])[c:26]2[c:27]([F:33])[cH:28][c:29]([F:32])[cH:30][cH:31]2)[CH3:34])[CH2:11]3)[cH:35][cH:36]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[cH:9][c:10]3[c:14]([cH:15][cH:16]2)[NH:13][N:12]([CH:17]([C:18]([CH2:19][n:20]2[n:21][cH:22][n:23][cH:24]2)([OH:25])[c:26]2[c:27]([F:33])[cH:28][c:29]([F:32])[cH:30][cH:31]2)[CH3:34])[CH2:11]3)[CH2:37][CH3:38])[cH:35][cH:36]1

Participants

5

Reactant 4

HCID 6332Ethyl BromideHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 178462474HCID 178462474, compound

Product 1

HCID 178463697HCID 178463697, compound

Sources & evidence

ORD record
ord-68ecd6d05c3744d2bc3bb2bc964d5b18
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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