Ethanol → HCID 23024882, compound

HRID 183610Notes

Reaction equation

[CH3:131][c:132]1[cH:133][cH:134][cH:135][cH:136][cH:137]1.[CH3:50][CH2:51][OH:52].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[n:7]1[cH:8][c:9]([CH2:11][O:12][c:13]1[cH:14][cH:15][c:16]([CH2:17][n:18]3[n:19][c:20]([O:30][CH2:31][CH3:32])[c:21]([CH2:23][CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:22]3)[cH:33][cH:34]1)[n:10]2.[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[OH2:130].[OH:35][B:36]([OH:37])[c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[cH:53]1[cH:54][cH:55][c:56]([P:57]([Pd:58]([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[P:97]([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129]1>>[c:2]1(-[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:3][cH:4][cH:5][c:6]2[n:7]1[cH:8][c:9]([CH2:11][O:12][c:13]1[cH:14][cH:15][c:16]([CH2:17][n:18]3[n:19][c:20]([O:30][CH2:31][CH3:32])[c:21]([CH2:23][CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:22]3)[cH:33][cH:34]1)[n:10]2

Participants

Reactant 8

HCID 19660Carbonate Ion

HCID 66827Phenylboronic Acid

HCID 86760429HCID 86760429, compound

HCID 178420554HCID 178420554, compound

Product 1

HCID 23024882HCID 23024882, compound

Sources & evidence

ORD record: ord-86ff0260b0bd4d6195d283ab7ea160d7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…