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Hydrochloric Acid → 5-{4-[3-(2-Fluoro-5-methyl-phenylcarbamoyl)-phenoxy]-pyridin-2-yl}-1H-pyrrole-3-carboxylic acid

HRID 1137559
Notes
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Reaction equation

HRID 1137559 reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][nH:7][c:8](-[c:10]2[n:11][cH:12][cH:13][c:14]([O:16][c:17]3[cH:18][c:19]([C:23]([NH:24][c:25]4[c:26]([F:32])[cH:27][cH:28][c:29]([CH3:31])[cH:30]4)=[O:33])[cH:20][cH:21][cH:22]3)[cH:15]2)[cH:9]1.[ClH:37].[Na+:35].[OH-:34].[OH2:36]>>[O:2]=[C:3]([OH:4])[c:5]1[cH:6][nH:7][c:8](-[c:10]2[n:11][cH:12][cH:13][c:14]([O:16][c:17]3[cH:18][c:19]([C:23]([NH:24][c:25]4[c:26]([F:32])[cH:27][cH:28][c:29]([CH3:31])[cH:30]4)=[O:33])[cH:20][cH:21][cH:22]3)[cH:15]2)[cH:9]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 510016275-{4-[3-(2-Fluoro-5-methyl-phenylcarbamoyl)-phenoxy]-pyridin-2-yl}-1H-pyrrole-3-carboxylic acid methyl ester

Product 1

HCID 51001626
5-{4-[3-(2-Fluoro-5-methyl-phenylcarbamoyl)-phenoxy]-pyridin-2-yl}-1H-pyrrole-3-carboxylic acid

Sources & evidence

ORD record
ord-eaf939af44d74efabe5b817a9de14fd0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes