Hydrochloric Acid → HCID 68576445, compound

HRID 138783Notes

Reaction equation

[CH3:38][CH2:39][OH:40].[ClH:34].[OH-:35].[OH-:37].[Pd+2:36].[c:1]1([CH:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:28]2)[N:8]2[CH2:9][CH:10]([CH2:12][O:13][c:14]3[cH:15][cH:16][c:17]([C:20]4([C:26]#[N:27])[CH2:21][CH2:22][O:23][CH2:24][CH2:25]4)[cH:18][cH:19]3)[CH2:11]2)[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[NH:8]1[CH2:9][CH:10]([CH2:12][O:13][c:14]2[cH:15][cH:16][c:17]([C:20]3([C:26]#[N:27])[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[cH:18][cH:19]2)[CH2:11]1

Participants

Reactant 5

HCID 313Hydrochloric Acid

HCID 702Ethanol

HCID 961Hydroxide2×

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

HCID 68576812HCID 68576812, compound

Product 1

HCID 68576445HCID 68576445, compound

Sources & evidence

ORD record: ord-2cd3fd3121dc4e13af03e0b1667bc494
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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