Ammonium → HCID 21505571, compound

HRID 2130746Notes

Reaction equation

HRID 2130746 reaction equation
[C:28]([CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35])(=[O:36])[Cl:37].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:27]1)[C:8]([N:17]1[CH2:18][CH2:19][N:20]([CH2:23][CH2:24][CH2:25][OH:26])[CH2:21][CH2:22]1)=[CH:9][c:10]1[c:11]([cH:13][cH:14][cH:15][cH:16]1)[S:12]2.[NH4+:39].[OH-:40].[OH2:38].[cH:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:27]1)[C:8]([N:17]1[CH2:18][CH2:19][N:20]([CH2:23][CH2:24][CH2:25][O:26][C:28]([CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35])=[O:36])[CH2:21][CH2:22]1)=[CH:9][c:10]1[c:11]([cH:13][cH:14][cH:15][cH:16]1)[S:12]2

Participants

7

Reactant 6

HCID 223AmmoniumHCID 241BenzeneHCID 961HydroxideHCID 962WaterHCID 8124Octanoyl chlorideHCID 3038748HCID 3038748, compound

Product 1

HCID 21505571HCID 21505571, compound

Sources & evidence

ORD record
ord-0e8ada8ab47c4a619339cf24355b9721
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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