Bicarbonate Ion → HCID 57537614, compound

HRID 2347910Notes

Reaction equation

HRID 2347910 reaction equation
[C:51](=[O:52])([OH:53])[O-:54].[CH3:41][C:42]#[N:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][c:7]1-[c:8]1[cH:9][n:10][cH:11][c:12]([C:13](=[O:14])[N:15]([CH3:16])[CH3:17])[cH:18]1)[n:19]([CH2:23][O:24][CH2:25][CH2:26][Si:27]([CH3:28])([CH3:29])[CH3:30])[cH:20][c:21]2[I:22].[F:31][c:32]1[c:33]([B:38]([OH:39])[OH:40])[cH:34][cH:35][cH:36][cH:37]1.[Na+:55]>>[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][c:7]1-[c:8]1[cH:9][n:10][cH:11][c:12]([C:13](=[O:14])[N:15]([CH3:16])[CH3:17])[cH:18]1)[n:19]([CH2:23][O:24][CH2:25][CH2:26][Si:27]([CH3:28])([CH3:29])[CH3:30])[cH:20][c:21]2-[c:33]1[c:32]([F:31])[cH:37][cH:36][cH:35][cH:34]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 27343542-Fluorophenylboronic acidHCID 57537599HCID 57537599, compound

Product 1

HCID 57537614HCID 57537614, compound

Sources & evidence

ORD record
ord-9cc1a54c23b44e5387b3322563273eb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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