Acetic Acid → 2-Chloro-3-hydroxybenzonitrile

HRID 106027

Reaction equation

HRID 106027 reaction equation
[CH3:14][C:15](=[O:16])[OH:17].[CH3:18][CH2:19][O:20][C:21](=[O:22])[CH3:23].[Cl-:11].[Cl:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][cH:8][c:9]1[OH:10].[OH:12][NH3+:13]>>[Cl:1][c:2]1[c:3]([C:4]#[N:13])[cH:6][cH:7][cH:8][c:9]1[OH:10]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 312ChlorideHCID 933HydroxyammoniumHCID 8857Ethyl AcetateHCID 5933762-Chloro-3-hydroxybenzaldehyde

Product 1

HCID 214365452-Chloro-3-hydroxybenzonitrile

Sources & evidence

ORD record
ord-9d93bd9072ae42479a1b43abd088275b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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