Ethanol → HCID 20130662, compound

HRID 1237875Notes

Reaction equation

HRID 1237875 reaction equation
[CH3:28][CH2:29][OH:30].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][c:10](-[n:13]2[c:14](=[O:25])[n:15]([CH3:24])[c:16]3[c:21]([c:22]2=[O:23])[CH2:20][CH2:19][CH2:18][CH2:17]3)[cH:11][cH:12]1.[Na+:27].[OH-:26].[OH2:31]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:9][c:10](-[n:13]2[c:14](=[O:25])[n:15]([CH3:24])[c:16]3[c:21]([c:22]2=[O:23])[CH2:20][CH2:19][CH2:18][CH2:17]3)[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 20130686ethyl 2-chloro-5-[1,4,5,6,7,8-hexahydro-1-methyl-2,4-dioxo-3(2H)-quinazolinyl]-benzoate

Product 1

HCID 20130662HCID 20130662, compound

Sources & evidence

ORD record
ord-b0151cc062f04c64ac75902db989d5bd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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