1-Butanol → HCID 86652179, compound

HRID 1557195Notes

Reaction equation

HRID 1557195 reaction equation
[Br:11][c:12]1[c:13]([CH:17]=[O:18])[s:14][cH:15][cH:16]1.[CH2:96]([OH:97])[CH2:98][CH2:99][CH3:100].[F:3][c:4]1[cH:5][cH:6][c:7]([SH:10])[cH:8][cH:9]1.[H-:1].[Na+:2].[cH:19]1[cH:20][cH:21][c:22]([P:23]([Pd:24]([P:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[cH:94][cH:95]1>>[F:3][c:4]1[cH:5][cH:6][c:7]([S:10][c:12]2[c:13]([CH:17]=[O:18])[s:14][cH:15][cH:16]2)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 2631-ButanolHCID 923Sodium ionHCID 677894-FluorothiophenolHCID 166653HydrideHCID 27970793-Bromothiophene-2-carboxaldehydeHCID 178420554HCID 178420554, compound

Product 1

HCID 86652179HCID 86652179, compound

Sources & evidence

ORD record
ord-022dc23801554a528dff45de3579be29
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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