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Sodium Ion → 3-[(4,5,7-Trifluorobenzothiazol-2-yl)methyl]phenylacetic acid

HRID 1145584
Notes
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Reaction equation

HRID 1145584 reaction equation
[F:1][c:2]1[c:3]([F:24])[cH:4][c:5]([F:23])[c:6]2[c:7]1[n:8][c:9]([CH2:11][c:12]1[cH:13][c:14]([CH2:18][C:19](=[O:20])[O:21][CH3:22])[cH:15][cH:16][cH:17]1)[s:10]2.[Na+:26].[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[OH-:25].[OH2:27]>>[F:1][c:2]1[c:3]([F:24])[cH:4][c:5]([F:23])[c:6]2[c:7]1[n:8][c:9]([CH2:11][c:12]1[cH:13][c:14]([CH2:18][C:19](=[O:20])[OH:21])[cH:15][cH:16][cH:17]1)[s:10]2
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 312751,4-DioxaneHCID 21463559Methyl 3-[(4,5,7-trifluorobenzothiazol-2-yl)methyl]phenylacetate

Product 1

HCID 98626253-[(4,5,7-Trifluorobenzothiazol-2-yl)methyl]phenylacetic acid

Sources & evidence

ORD record
ord-83bdeac3e3d744659df262058fe23aa0
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