Acetic Acid → 3-(4-Amino-6-methyl-1H-indazol-1-yl)benzoic acid

HRID 146600Notes

Reaction equation

HRID 146600 reaction equation
[Br:1][c:2]1[c:3]2[cH:4][n:5][n:6](-[c:12]3[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19][cH:20]3)[c:7]2[cH:8][c:9]([CH3:11])[cH:10]1.[CH3:22][C:23](=[O:24])[OH:25].[ClH:21].[Cu:27][I:28].[NH3:26]>>[c:2]1([NH2:26])[c:3]2[cH:4][n:5][n:6](-[c:12]3[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19][cH:20]3)[c:7]2[cH:8][c:9]([CH3:11])[cH:10]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 222AmmoniaHCID 313Hydrochloric AcidHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 576726453-(4-Bromo-6-methyl-1H-indazol-1-yl)benzoic acid

Product 1

HCID 576726463-(4-Amino-6-methyl-1H-indazol-1-yl)benzoic acid

Sources & evidence

ORD record
ord-9cea330f46a0411b9e964820744aa1b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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