Ethanol → HCID 10806855, compound

HRID 1205382Notes

Reaction equation

HRID 1205382 reaction equation
[CH2:1]([O:2][c:4]1[c:5](=[O:12])[c:6](=[O:11])[c:7]1[O:8][CH2:9][CH3:10])[CH3:3].[CH3:13][C:14]([CH3:15])([CH3:16])[O:17][C:18]([NH:19][CH2:20][CH2:21][CH2:22][NH:23][CH2:24][C:25]#[N:26])=[O:27].[CH3:28][CH2:29][OH:30]>>[c:4]1([N:23]([CH2:22][CH2:21][CH2:20][NH:19][C:18]([O:17][C:14]([CH3:13])([CH3:15])[CH3:16])=[O:27])[CH2:24][C:25]#[N:26])[c:5](=[O:12])[c:6](=[O:11])[c:7]1[O:8][CH2:9][CH3:10]

Participants

4

Reactant 3

HCID 702EthanolHCID 123228Diethyl squarateHCID 10560546Carbamic acid, [3-[(cyanomethyl)amino]propyl]-, 1,1-dimethylethyl ester

Product 1

HCID 10806855HCID 10806855, compound

Sources & evidence

ORD record
ord-da456ddf21a843e1bf5f8ad48313194c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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