Sodium ion → HCID 22450621, compound

HRID 211003

Reaction equation

[CH3:51][CH2:52][CH2:53][CH2:54][CH2:55][CH3:56].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[Cl:11][c:12]1[cH:13][c:14]([CH2:15][Br:16])[cH:17][cH:18][cH:19]1.[H-:25].[Li+:37].[Na+:26].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1.[OH-:38].[OH2:50].[c:27]1([S:28]([O:29][CH3:30])=[O:31])[cH:32][cH:33][cH:34][cH:35][cH:36]1.[nH:1]1[cH:2][cH:3][c:4]2[c:9]1[CH2:8][CH2:7][CH2:6][C:5]2=[O:10].[nH:20]1[cH:21][cH:22][cH:23][cH:24]1>>[n:1]1([CH2:15][c:14]2[cH:13][c:12]([Cl:11])[cH:19][cH:18][cH:17]2)[cH:2][cH:3][c:4]2[c:9]1[CH2:8][CH2:7][CH2:6][C:5]2=[O:10]

Participants

Reactant 13

HCID 8028Tetrahydrofuran

HCID 8058Hexane

HCID 8857Ethyl Acetate

HCID 28486Lithium ion

HCID 312751,4-Dioxane

HCID 698381-(Bromomethyl)-3-chlorobenzene

HCID 166653Hydride

HCID 2802291,5,6,7-Tetrahydro-4H-indol-4-one

HCID 2759784Methyl benzenesulfinate

Product 1

HCID 22450621HCID 22450621, compound

Sources & evidence

ORD record: ord-e77f07861f7542099a1b24764ecdf1e4
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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