Tetrahydrofuran → Methyl 2-[2-methyl-4-[3-(4-methylphenyl)-3-[4-(3-pyrazol-1-ylprop-1-ynyl)phenyl]prop-2-enoxy]phenoxy]acetate
Reaction equation
[CH2:32]([C:33]#[CH:34])[n:35]1[n:36][cH:37][cH:38][cH:39]1.[CH3:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11][c:12]([O:14][CH2:15][CH:16]=[C:17]([c:18]2[cH:19][cH:20][c:21]([CH3:24])[cH:22][cH:23]2)[c:25]2[cH:26][cH:27][c:28]([I:31])[cH:29][cH:30]2)[cH:13]1.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cu:129][I:130].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[CH3:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11][c:12]([O:14][CH2:15][CH:16]=[C:17]([c:18]2[cH:19][cH:20][c:21]([CH3:24])[cH:22][cH:23]2)[c:25]2[cH:26][cH:27][c:28]([C:34]#[C:33][CH2:32][n:35]3[n:36][cH:37][cH:38][cH:39]3)[cH:29][cH:30]2)[cH:13]1Participants
7
Reactant 6
HCID 8028Tetrahydrofuran
HCID 8471Triethylamine
HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)
HCID 117685231-(prop-2-yn-1-yl)-1H-pyrazole
HCID 123554747Methyl 2-[4-[3-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enoxy]-2-methylphenoxy]acetate
HCID 178420554HCID 178420554, compoundProduct 1
Sources & evidence
- ORD record
- ord-313a2f5fedd74f12a6a7a37c5d035470
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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