Acetic Acid → HCID 178527349, compound

HRID 2321109Notes

Reaction equation

HRID 2321109 reaction equation
[CH3:43][C:44](=[O:45])[OH:46].[CH3:47][OH:48].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([NH:17][c:18]3[n:19][cH:20][cH:21][c:22](-[c:24]4[c:25](-[c:32]5[cH:33][c:34]([CH:35]=[O:36])[cH:37][cH:38][cH:39]5)[n:26][c:27]5[s:28][cH:29][cH:30][n:31]45)[n:23]3)[CH2:14][CH2:15][CH2:16]2)[cH:6][cH:7]1.[Cl:49][CH2:50][Cl:51].[ClH:40].[NH2:41][OH:42]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([NH:17][c:18]3[n:19][cH:20][cH:21][c:22](-[c:24]4[c:25](-[c:32]5[cH:33][c:34]([CH:35]=[N:41][OH:42])[cH:37][cH:38][cH:39]5)[n:26][c:27]5[s:28][cH:29][cH:30][n:31]45)[n:23]3)[CH2:14][CH2:15][CH2:16]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 787HydroxylamineHCID 887MethanolHCID 6344DichloromethaneHCID 178519551HCID 178519551, compound

Product 1

HCID 178527349HCID 178527349, compound

Sources & evidence

ORD record
ord-fccae38a81d848c28c5ed57a49f285da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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