Acetone → 2-(8-Iodooctyl)-4,5,6,7-tetramethoxyindan

HRID 2161769

Reaction equation

HRID 2161769 reaction equation
[CH3:1][S:2]([O:3][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH:14]1[CH2:15][c:16]2[c:17]([O:29][CH3:30])[c:18]([O:27][CH3:28])[c:19]([O:25][CH3:26])[c:20]([O:23][CH3:24])[c:21]2[CH2:22]1)(=[O:4])=[O:5].[CH3:34][C:35](=[O:36])[CH3:37].[I-:32].[Na+:31].[OH2:33]>>[CH2:6]([CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH:14]1[CH2:15][c:16]2[c:17]([O:29][CH3:30])[c:18]([O:27][CH3:28])[c:19]([O:25][CH3:26])[c:20]([O:23][CH3:24])[c:21]2[CH2:22]1)[I:32]

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 962WaterHCID 30165Iodide IonHCID 183485438-(4,5,6,7-Tetramethoxyindan-2-yl)octyl methanesulfonate

Product 1

HCID 183485412-(8-Iodooctyl)-4,5,6,7-tetramethoxyindan

Sources & evidence

ORD record
ord-7abf1915faaa49cd991fdc7b14d2691d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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