Acetic Acid → HCID 178504145, compound

HRID 1203274Notes

Reaction equation

HRID 1203274 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][C:10](=[S:11])[NH:12][c:13]1[c:14]([C:30](=[O:31])[NH2:32])[n:15][cH:16][n:17]1[O:18][CH2:19][CH2:20][CH2:21][O:22][CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH3:35][I:36].[CH3:37][C:38](=[O:39])[OH:40].[Na+:34].[OH-:33]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][C:10](=[SH:11][CH3:35])[NH:12][c:13]1[c:14]([C:30](=[O:31])[NH2:32])[n:15][cH:16][n:17]1[O:18][CH2:19][CH2:20][CH2:21][O:22][CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 6328Methyl iodideHCID 22160582HCID 22160582, compound

Product 1

HCID 178504145HCID 178504145, compound

Sources & evidence

ORD record
ord-85aae919a56e47c4b3094b985de5a530
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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