Acetic Acid → HCID 67200327, compound

HRID 1567830Notes

Reaction equation

HRID 1567830 reaction equation
[C:52]([OH:53])(=[O:54])[CH3:55].[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:10]2[c:11]([NH:18][C:19]([CH:20]([NH:21][C:9]([O:22][CH2:23][CH:24]3[c:25]4[cH:26][cH:27][cH:28][cH:29][c:30]4-[c:31]4[c:32]3[cH:33][cH:34][cH:35][cH:36]4)=[O:37])[CH2:39][C:40](=[O:41])[O:42][CH3:43])=[O:44])[cH:12][cH:13][c:14]([O:16][CH3:17])[cH:15]2)=[O:38])[cH:6][cH:7]1.[Cl:56][CH2:57][Cl:58]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2=[N:21][CH:20]([CH2:39][C:40](=[O:41])[O:42][CH3:43])[C:19](=[O:44])[NH:18][c:11]3[c:10]2[cH:15][c:14]([O:16][CH3:17])[cH:13][cH:12]3)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 77235653HCID 77235653, compound

Product 1

HCID 67200327HCID 67200327, compound

Sources & evidence

ORD record
ord-3877c4da87ef4b2ea8be2689077b9bb3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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