Triethylamine → HCID 22568835, compound

HRID 2321471Notes

Reaction equation

HRID 2321471 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9]1([c:12]2[cH:13][cH:14][c:15]([C:18]#[CH:19])[cH:16][cH:17]2)[CH2:10][CH2:11]1)[CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[CH2:27]([CH3:28])[O:29][C:30]([c:31]1[cH:32][cH:33][c:34]([I:37])[cH:35][cH:36]1)=[O:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Cu:46][I:47].[Pd:48]([Cl:49])[Cl:50].[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1.[c:70]1([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[cH:84][cH:85][cH:86][cH:87][cH:88]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9]1([c:12]2[cH:13][cH:14][c:15]([C:18]#[C:19][c:34]3[cH:33][cH:32][c:31]([C:30]([O:29][CH2:27][CH3:28])=[O:38])[cH:36][cH:35]3)[cH:16][cH:17]2)[CH2:10][CH2:11]1)[CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1

Participants

7

Reactant 6

HCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 142891Ethyl 4-iodobenzoateHCID 22568868HCID 22568868, compound

Product 1

HCID 22568835HCID 22568835, compound

Sources & evidence

ORD record
ord-42befe5814ef4d1190b3b6af8e10153f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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