Ethanol → HCID 67099623, compound

HRID 1238114Notes

Reaction equation

HRID 1238114 reaction equation
[CH3:32][c:33]1[cH:34][cH:35][c:36]([S:37]([OH:38])(=[O:39])=[O:40])[cH:41][cH:42]1.[CH3:43][CH2:44][OH:45].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[Cl:1][c:2]1[c:3]([C:20]2([C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH2:21][CH2:22][O:23][CH2:24][CH2:25]2)[c:4]([C:8]#[C:9][C:10]([O:11][CH2:12][CH3:13])([O:14][CH2:18][CH3:19])[O:15][CH2:16][CH3:17])[cH:5][cH:6][cH:7]1.[OH2:31].[OH2:46]>>[Cl:1][c:2]1[c:3]([C:20]2([C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH2:21][CH2:22][O:23][CH2:24][CH2:25]2)[c:4]([C:8]#[C:9][C:10]([O:11][CH2:12][CH3:13])=[O:14])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 962Water2×HCID 6101p-Toluenesulfonic acidHCID 8857Ethyl AcetateHCID 67100193ethyl 4-(2-chloro-6-(3,3,3-triethoxyprop-1-ynyl)phenyl)-tetrahydro-2H-pyran-4-carboxylate

Product 1

HCID 67099623HCID 67099623, compound

Sources & evidence

ORD record
ord-c6cc2ffd16de4b5ea645a45aea34f59c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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