Acetate → 2-Hydroxy-4-methoxybenzonitrile

HRID 1229718Notes

Reaction equation

HRID 1229718 reaction equation
[CH3:13][C:14](=[O:15])[O-:16].[CH3:17][CH2:18][N+:19](=[O:20])[O-:21].[CH3:23][C:24](=[O:25])[OH:26].[Na+:12].[OH2:22].[OH:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][c:8]([O:10][CH3:11])[cH:9]1>>[OH:1][c:2]1[c:3]([C:4]#[N:19])[cH:6][cH:7][c:8]([O:10][CH3:11])[cH:9]1

Participants

7

Reactant 6

HCID 175AcetateHCID 176Acetic AcidHCID 923Sodium ionHCID 962WaterHCID 6587NitroethaneHCID 696002-Hydroxy-4-Methoxybenzaldehyde

Product 1

HCID 114236802-Hydroxy-4-methoxybenzonitrile

Sources & evidence

ORD record
ord-17ac7f02b5e148af8cab0decbce294b2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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