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Hydrochloric Acid → {5-[2-Chloro-4-(ethylsulfonyl)phenoxy]biphenyl-3-yl}acetic acid

HRID 1119050
Notes
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Reaction equation

HRID 1119050 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH2:21][C:22](=[O:23])[OH:24])[cH:5][c:6]([O:8][c:9]2[c:10]([Cl:20])[cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH2:18][CH3:19])[cH:13][cH:14]2)[cH:7]1.[ClH:46].[Na+:34].[Na+:35].[O-:36][C:37](=[O:38])[O-:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[c:25]1([B:31]([OH:32])[OH:33])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[c:2]1(-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:3][c:4]([CH2:21][C:22](=[O:23])[OH:24])[cH:5][c:6]([O:8][c:9]2[c:10]([Cl:20])[cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH2:18][CH3:19])[cH:13][cH:14]2)[cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium Ion2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 66827Phenylboronic AcidHCID 57791934{3-Bromo-5-[2-chloro-4-(ethylsulfonyl)phenoxy]phenyl}acetic acid

Product 1

HCID 57791961
{5-[2-Chloro-4-(ethylsulfonyl)phenoxy]biphenyl-3-yl}acetic acid

Sources & evidence

ORD record
ord-2a73969bca134e8c996264f571dcb515
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