Ethanol → 4-(2',3'-Dimethoxyphenyl) 3-phenylbutyric acid

HRID 202154

Reaction equation

HRID 202154 reaction equation
[CH3:1][O:2][c:3]1[c:4]([CH2:11][CH:12]([CH2:13][C:14]#[N:15])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:5][cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:25][CH2:26][OH:27].[Na+:23].[OH-:22].[OH2:24]>>[CH3:1][O:2][c:3]1[c:4]([CH2:11][CH:12]([CH2:13][C:14](=[O:22])[OH:24])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:5][cH:6][cH:7][c:8]1[O:9][CH3:10]

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 199611014-(2',3'-Dimethoxyphenyl)-3-phenylbutanenitrile

Product 1

HCID 124785434-(2',3'-Dimethoxyphenyl) 3-phenylbutyric acid

Sources & evidence

ORD record
ord-e5c8e19b72444259a7ff23fc23717ed5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

Loading…