Ethanol → HCID 9161578, compound

HRID 2155866Notes

Reaction equation

HRID 2155866 reaction equation
[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[CH3:40][CH2:41][OH:42].[Cl:1][c:2]1[cH:3][c:4]([CH2:5][N:6]2[CH2:7][CH2:8][N:9]([c:12]3[cH:13][cH:14][c:15]([N+:18]([O-:19])=[O:20])[cH:16][cH:17]3)[CH2:10][CH2:11]2)[cH:21][cH:22][cH:23]1.[Na+:33].[O-:29][C:30]([OH:31])=[O:32].[OH2:24].[OH2:25].[Sn:26]([Cl:27])[Cl:28]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][N:6]2[CH2:7][CH2:8][N:9]([c:12]3[cH:13][cH:14][c:15]([NH2:18])[cH:16][cH:17]3)[CH2:10][CH2:11]2)[cH:21][cH:22][cH:23]1

Participants

8

Reactant 7

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962Water2×HCID 8857Ethyl AcetateHCID 24479Stannous ChlorideHCID 2838608HCID 2838608, compound

Product 1

HCID 9161578HCID 9161578, compound

Sources & evidence

ORD record
ord-228080c8e97d4278ae3fc2c328d9b5b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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