Water → HCID 135681600, compound

HRID 123464Notes

Reaction equation

HRID 123464 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:29]#[N:30])[cH:5][c:6]2[c:7]1[n:8][c:9](-[c:11]1[c:12](=[O:28])[nH:13][cH:14][cH:15][c:16]1[NH:17][CH2:18][CH:19]([OH:20])[c:21]1[cH:22][c:23]([Cl:27])[cH:24][cH:25][cH:26]1)[nH:10]2.[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:31][CH:32]([CH2:33][AlH:34][CH2:35][CH:36]([CH3:37])[CH3:38])[CH3:39].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[OH2:46]>>[Br:1][c:2]1[cH:3][c:4]([CH:29]=[O:42])[cH:5][c:6]2[c:7]1[n:8][c:9](-[c:11]1[c:12](=[O:28])[nH:13][cH:14][cH:15][c:16]1[NH:17][CH2:18][CH:19]([OH:20])[c:21]1[cH:22][c:23]([Cl:27])[cH:24][cH:25][cH:26]1)[nH:10]2

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 14487Diisobutylaluminum hydrideHCID 136381861HCID 136381861, compound

Product 1

HCID 135681600HCID 135681600, compound

Sources & evidence

ORD record
ord-68056e2ae4dc4909b11db6604971336d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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