Ethanol → HCID 178436325, compound

HRID 197491Notes

Reaction equation

HRID 197491 reaction equation
[C:30]([O:31][CH2:32][CH3:33])(=[O:34])[CH3:35].[CH2:36]([OH:37])[CH3:38].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[CH2:9])[c:10]2[cH:11][cH:12][c:13](-[c:16]3[n:17][c:18]4[c:19]([nH:20]3)[cH:21][cH:22][c:23]([C:25](=[O:26])[NH2:27])[cH:24]4)[cH:14][cH:15]2)[cH:6][cH:7]1.[N:28]#[N:29]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH3:9])[c:10]2[cH:11][cH:12][c:13](-[c:16]3[n:17][c:18]4[c:19]([nH:20]3)[cH:21][cH:22][c:23]([C:25](=[O:26])[NH2:27])[cH:24]4)[cH:14][cH:15]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 947NitrogenHCID 8857Ethyl AcetateHCID 178436324HCID 178436324, compound

Product 1

HCID 178436325HCID 178436325, compound

Sources & evidence

ORD record
ord-9d5114f7a84645c7989fdd9e44c5233c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…