Sodium ion → HCID 11519067, compound

HRID 1550356Notes

Reaction equation

HRID 1550356 reaction equation
[Br:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]([NH:9][C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]1.[C:27](=[O:28])([O-:29])[O-:30].[CH3:47][O:48][CH2:49][CH2:50][O:51][CH3:52].[F:33][C:34]([O:35][c:36]1[c:37]([B:42]([OH:43])[OH:44])[cH:38][cH:39][cH:40][cH:41]1)([F:45])[F:46].[Na+:31].[Na+:32]>>[c:2]1(-[c:37]2[c:36]([O:35][C:34]([F:33])([F:45])[F:46])[cH:41][cH:40][cH:39][cH:38]2)[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]([NH:9][C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27772042-(Trifluoromethoxy)phenylboronic Acid (contains varying amounts of Anhydride)HCID 58689900HCID 58689900, compound

Product 1

HCID 11519067HCID 11519067, compound

Sources & evidence

ORD record
ord-524c36c4cb0f4870a293d919d2958c3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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