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Hydrochloric Acid → 2-{2-[5(4-Fluoro-phenyl)-3-(2,4,6-trifluoro-benzoyl)-2,3-dihydro [1,3,4]thiadiazol-2-yl]-phenoxymethyl}-furan-3-carboxylic acid

HRID 2334192
Notes
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Reaction equation

HRID 2334192 reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH2:10][O:11][c:12]2[c:13]([CH:18]3[S:19][C:20]([c:34]4[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]4)=[N:21][N:22]3[C:23]([c:24]3[c:25]([F:32])[cH:26][c:27]([F:31])[cH:28][c:29]3[F:30])=[O:33])[cH:14][cH:15][cH:16][cH:17]2)[o:7][cH:8][cH:9]1.[CH3:49][OH:50].[ClH:43].[Li+:42].[OH-:41].[OH2:51]>>[O:2]=[C:3]([OH:4])[c:5]1[c:6]([CH2:10][O:11][c:12]2[c:13]([CH:18]3[S:19][C:20]([c:34]4[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]4)=[N:21][N:22]3[C:23]([c:24]3[c:25]([F:32])[cH:26][c:27]([F:31])[cH:28][c:29]3[F:30])=[O:33])[cH:14][cH:15][cH:16][cH:17]2)[o:7][cH:8][cH:9]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 672793392-{2-[5(4-Fluoro-phenyl)-3-(2,4,6-trifluoro-benzoyl)-2,3-dihydro-[1,3,4]thiadiazol-2-yl]-phenoxymethyl}-furan-3-carboxylic acid methyl ester

Product 1

HCID 580256232-{2-[5(4-Fluoro-phenyl)-3-(2,4,6-trifluoro-benzoyl)-2,3-dihydro [1,3,4]thiadiazol-2-yl]-phenoxymethyl}-furan-3-carboxylic acid

Sources & evidence

ORD record
ord-13ca3bda694e486eac074c23087efb94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes