Ethanol → HCID 178456292, compound

HRID 91253Notes

Reaction equation

HRID 91253 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][NH:6][C:7](=[O:8])[C:9]1([CH3:38])[CH2:10][NH:11][CH2:12][CH2:13][CH:14]1[NH:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22]([O:25][CH2:26][c:27]2[cH:28][c:29]([CH3:37])[n:30][c:31]3[cH:32][cH:33][cH:34][cH:35][c:36]23)[cH:23][cH:24]1.[C:41](=[O:42])([O-:43])[O-:44].[CH2:47]([C:48]#[CH:49])[Cl:50].[CH3:51][CH2:52][OH:53].[I-:40].[K+:45].[K+:46].[Na+:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][NH:6][C:7](=[O:8])[C:9]1([CH3:38])[CH2:10][N:11]([CH2:49][C:48]#[CH:47])[CH2:12][CH2:13][CH:14]1[NH:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22]([O:25][CH2:26][c:27]2[cH:28][c:29]([CH3:37])[n:30][c:31]3[cH:32][cH:33][cH:34][cH:35][c:36]23)[cH:23][cH:24]1

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 923Sodium ionHCID 122213-Chloro-1-propyneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 178426774HCID 178426774, compound

Product 1

HCID 178456292HCID 178456292, compound

Sources & evidence

ORD record
ord-86f3ede16f1445f39a0017890523f1b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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