Ethanol → HCID 67265137, compound

HRID 310813Notes

Reaction equation

HRID 310813 reaction equation
[CH3:14][O:15][c:16]1[c:17]([N+:33]([O-:34])=[O:35])[cH:18][cH:19][c:20]2[c:21]1[CH2:22][CH2:23][CH2:24][CH:25]([N:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1)[CH2:26]2.[CH3:36][C:37]#[N:38].[CH3:39][CH2:40][OH:41].[K+:8].[O-:9][N+:10](=[O:11])[O-:12].[OH2:13].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[CH3:14][O:15][c:16]1[c:17]([NH2:33])[cH:18][cH:19][c:20]2[c:21]1[CH2:22][CH2:23][CH2:24][CH:25]([N:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1)[CH2:26]2

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium CationHCID 943NitrateHCID 962WaterHCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 67263902HCID 67263902, compound

Product 1

HCID 67265137HCID 67265137, compound

Sources & evidence

ORD record
ord-407322c81679486bbbe77bbc7f91ac76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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