Acetic Acid → HCID 20152418, compound

HRID 143920Notes

Reaction equation

HRID 143920 reaction equation
[CH3:26][C:27](=[O:28])[OH:29].[Cl:1][c:2]1[c:3](-[c:8]2[o:9][c:10]([CH3:25])[c:11]([CH2:13][CH2:14][O:15][c:16]3[cH:17][cH:18][c:19]([N+:22]([O-:23])=[O:24])[cH:20][cH:21]3)[n:12]2)[cH:4][cH:5][cH:6][cH:7]1.[Fe:30].[OH2:31]>>[Cl:1][c:2]1[c:3](-[c:8]2[o:9][c:10]([CH3:25])[c:11]([CH2:13][CH2:14][O:15][c:16]3[cH:17][cH:18][c:19]([NH2:22])[cH:20][cH:21]3)[n:12]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 23925IronHCID 137139694-{2-[2-(2-Chlorophenyl)-5-methyl-4-oxazolyl]ethoxy}nitrobenzene

Product 1

HCID 20152418HCID 20152418, compound

Sources & evidence

ORD record
ord-893d5b72d1c8436b88b7155d34c25eba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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