Bicarbonate Ion → 2-(1,3-Thiazol-2-yl)benzaldehyde

HRID 1225914Notes

Reaction equation

HRID 1225914 reaction equation
[Br:1][c:2]1[s:3][cH:4][cH:5][n:6]1.[CH3:23][O:24][CH2:25][CH2:26][O:27][CH3:28].[CH:7](=[O:8])[c:9]1[c:10]([B:15]([OH:16])[OH:17])[cH:11][cH:12][cH:13][cH:14]1.[Na+:22].[O-:18][C:19]([OH:20])=[O:21].[OH2:29].[Pd:30].[c:31]1([P:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46][cH:47][cH:48][cH:49]1.[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1.[c:69]1([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[cH:83][cH:84][cH:85][cH:86][cH:87]1.[c:88]1([P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[cH:102][cH:103][cH:104][cH:105][cH:106]1>>[c:2]1(-[c:10]2[c:9]([CH:7]=[O:8])[cH:14][cH:13][cH:12][cH:11]2)[s:3][cH:4][cH:5][n:6]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine4×HCID 23938PalladiumHCID 764302-BromothiazoleHCID 2921892-Formylphenylboronic acid

Product 1

HCID 155324822-(1,3-Thiazol-2-yl)benzaldehyde

Sources & evidence

ORD record
ord-fc0bfee2ebe544f68278dc790250d598
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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