Ethanol → HCID 10270892, compound

HRID 1141438Notes

Reaction equation

HRID 1141438 reaction equation
[CH3:1][CH:2]([C:3](=[O:4])[O-:5])[c:6]1[cH:7][cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]([C:26]([CH3:27])([CH3:28])[CH3:29])[c:17]([C:20]3([O:23][CH2:24][CH3:25])[CH2:21][CH2:22]3)[cH:18][cH:19]2)[cH:10][cH:11]1.[CH3:33][C:34]#[N:35].[CH3:36][CH2:37][OH:38].[Na+:31].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:30].[OH2:32]>>[CH2:2]([C:3](=[O:4])[OH:5])[c:6]1[cH:7][cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]([C:26]([CH3:27])([CH3:28])[CH3:29])[c:17]([C:20]3([O:23][CH2:24][CH3:25])[CH2:21][CH2:22]3)[cH:18][cH:19]2)[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6342AcetonitrileHCID 8028TetrahydrofuranHCID 178465763HCID 178465763, compound

Product 1

HCID 10270892HCID 10270892, compound

Sources & evidence

ORD record
ord-0bab42cdd3e542a4b26db454b45755a0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…