Acetone → Hydrochloric Acid

HRID 175067Notes

Reaction equation

HRID 175067 reaction equation
[CH3:17][C:18](=[O:19])[CH3:20].[CH3:21][C:22]#[N:23].[CH3:24][CH2:25][OH:26].[CH:11]([CH3:12])([CH3:13])[N:14]=[C:15]=[S:16].[ClH:1].[nH:2]1[cH:3][n:4][c:5]2[c:10]1[CH2:9][CH2:8][NH:7][CH2:6]2>>[ClH:1].[nH:2]1[cH:3][n:4][c:5]2[c:10]1[CH2:9][CH2:8][N:7]([C:15]([NH:14][CH:11]([CH3:12])[CH3:13])=[S:16])[CH2:6]2

Participants

8

Reactant 6

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 702EthanolHCID 6342AcetonitrileHCID 75263Isopropyl IsothiocyanateHCID 178420865HCID 178420865, compound

Product 2

HCID 313Hydrochloric AcidHCID 178458025HCID 178458025, compound

Sources & evidence

ORD record
ord-681a4a9f234d45f7b0db740d79d16a8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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