Acetone → HCID 54049765, compound

HRID 1137446Notes

Reaction equation

HRID 1137446 reaction equation
[C:27]([O:28][CH:29]([CH3:30])[Cl:31])([O:32][CH2:33][CH3:34])=[O:35].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:38][C:39](=[O:40])[CH3:41].[I-:37].[Na+:36].[s:1]1[c:2]([CH:6]=[CH:7][C:8](=[O:9])[NH:10][c:11]2[c:12]([C:13](=[O:14])[OH:15])[cH:16][cH:17][cH:18][cH:19]2)[cH:3][cH:4][cH:5]1>>[s:1]1[c:2]([CH:6]=[CH:7][C:8](=[O:9])[NH:10][c:11]2[c:12]([C:13](=[O:14])[O:15][CH:29]([O:28][C:27]([O:32][CH2:33][CH3:34])=[O:35])[CH3:30])[cH:16][cH:17][cH:18][cH:19]2)[cH:3][cH:4][cH:5]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 923Sodium ionHCID 8471TriethylamineHCID 30165Iodide IonHCID 162095Carbonic acid, 1-chloroethyl ethyl esterHCID 3063368HCID 3063368, compound

Product 1

HCID 54049765HCID 54049765, compound

Sources & evidence

ORD record
ord-3eee8768fd114ec69cd1330f17bcfcec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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