Water → Benzeneacetic acid, alpha-methyl-, ethyl ester

HRID 147319

Reaction equation

HRID 147319 reaction equation
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:14][CH:15]([N-:16][CH:17]([CH3:18])[CH3:19])[CH3:20].[CH3:21][I:22].[CH3:23][N:24]1[CH2:25][CH2:26][CH2:27][N:28]([CH3:29])[C:30]1=[O:31].[Li+:13].[OH2:37].[c:1]1([CH2:7][C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[CH3:14])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 962WaterHCID 6328Methyl iodideHCID 7590Ethyl phenylacetateHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 5062348Diisopropylamide

Product 1

HCID 99643Benzeneacetic acid, alpha-methyl-, ethyl ester

Sources & evidence

ORD record
ord-2b913c9d129043e9b66e5c51ba6ef0c8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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