Hydrochloric Acid → 4-Amino-3-fluoro-2-(2-methyl-4-trifluoromethoxy-phenylamino)-5-nitro-benzoic acid methyl ester

HRID 1143494Notes

Reaction equation

HRID 1143494 reaction equation
[CH3:17][c:18]1[c:19]([NH2:29])[cH:20][cH:21][c:22]([O:24][C:25]([F:26])([F:27])[F:28])[cH:23]1.[CH3:1][O:2][C:3]([c:4]1[c:5]([F:15])[c:6]([F:14])[c:7]([NH2:13])[c:8]([N+:10](=[O:11])[O-:12])[cH:9]1)=[O:16].[CH3:31][CH2:32][O:33][CH2:34][CH3:35].[ClH:30]>>[CH3:1][O:2][C:3]([c:4]1[c:5]([NH:29][c:19]2[c:18]([CH3:17])[cH:23][c:22]([O:24][C:25]([F:26])([F:27])[F:28])[cH:21][cH:20]2)[c:6]([F:14])[c:7]([NH2:13])[c:8]([N+:10](=[O:11])[O-:12])[cH:9]1)=[O:16]

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 3283Diethyl EtherHCID 2759749Benzoic acid, 4-amino-2,3-difluoro-5-nitro-, methyl esterHCID 27755462-Methyl-4-(trifluoromethoxy)aniline

Product 1

HCID 866216094-Amino-3-fluoro-2-(2-methyl-4-trifluoromethoxy-phenylamino)-5-nitro-benzoic acid methyl ester

Sources & evidence

ORD record
ord-87765174866743e8ab458ccf7f99b50e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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