Acetone → HCID 12940163, compound

HRID 294733Notes

Reaction equation

HRID 294733 reaction equation
[C:1]([O:2][CH2:3][CH3:4])(=[O:5])[Cl:6].[CH2:7]([CH2:8][CH2:9][CH3:10])[S:11][CH:12]([C:13]([Cl:14])([Cl:15])[Cl:16])[NH:17][C:18]([c:19]1[c:20]([OH:25])[cH:21][cH:22][cH:23][cH:24]1)=[O:26].[CH3:27][C:28](=[O:29])[CH3:30].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37]>>[C:1]([O:2][CH2:3][CH3:4])(=[O:5])[O:25][c:20]1[c:19]([C:18]([NH:17][CH:12]([S:11][CH2:7][CH2:8][CH2:9][CH3:10])[C:13]([Cl:14])([Cl:15])[Cl:16])=[O:26])[cH:24][cH:23][cH:22][cH:21]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 12940146HCID 12940146, compound

Product 1

HCID 12940163HCID 12940163, compound

Sources & evidence

ORD record
ord-23337b83c9b84dbdb2d7909e5d191d8b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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