Ethyl Acetate → HCID 86651425, compound

HRID 2341934Notes

Reaction equation

HRID 2341934 reaction equation
[Br:35][CH2:36][CH:37]1[CH2:38][O:39]1.[C:29](=[O:30])([O-:31])[O-:32].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[CH:1]1([NH:7][C:8]([CH2:9][c:10]2[cH:11][c:12]([I:27])[c:13]([O:17][c:18]3[cH:19][c:20]([I:26])[c:21]([OH:25])[c:22]([I:24])[cH:23]3)[c:14]([I:16])[cH:15]2)=[O:28])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cs+:33].[Cs+:34].[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1>>[CH:1]1([NH:7][C:8]([CH2:9][c:10]2[cH:11][c:12]([I:27])[c:13]([O:17][c:18]3[cH:19][c:20]([I:26])[c:21]([O:25][CH2:36][CH:37]4[CH2:38][O:39]4)[c:22]([I:24])[cH:23]3)[c:14]([I:16])[cH:15]2)=[O:28])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 8857Ethyl AcetateHCID 18430EpibromohydrinHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 67065315HCID 67065315, compound

Product 1

HCID 86651425HCID 86651425, compound

Sources & evidence

ORD record
ord-a21904c14fb34c42ae0aa1621e187b75
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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