Acetic Acid → HCID 57863431, compound

HRID 676530Notes

Reaction equation

HRID 676530 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][c:26](-[c:28]3[cH:29][n:30][n:31]([S:33](=[O:34])(=[O:35])[N:36]([CH3:37])[CH3:38])[cH:32]3)[cH:27]4)[cH:17][cH:18]2)=[O:39])[n:8][o:9]1.[C:46]([OH:47])(=[O:48])[CH3:49].[CH3:43][OH:44].[Cl:40][CH2:41][Cl:42].[ClH:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][c:26](-[c:28]3[cH:29][n:30][nH:31][cH:32]3)[cH:27]4)[cH:17][cH:18]2)=[O:39])[n:8][o:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 6344DichloromethaneHCID 68541667HCID 68541667, compound

Product 1

HCID 57863431HCID 57863431, compound

Sources & evidence

ORD record
ord-669673e1087c467c9179d67e69c12b00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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