Acetic Acid → HCID 53739186, compound

HRID 177748Notes

Reaction equation

HRID 177748 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH3:13])[c:14]1[s:15][c:16]([CH3:19])[n:17][n:18]1.[CH3:20][n:21]1[c:22]([CH:29]=[O:30])[n:23][cH:24][c:25]1[N+:26](=[O:27])[O-:28].[CH3:31][C:32]([O:33][C:34](=[O:35])[CH3:36])=[O:37].[CH3:38][C:39](=[O:40])[OH:41].[Cl-:42].[Cl-:44].[Zn+2:43]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH3:13])[c:14]1[s:15][c:16]([CH:19]=[CH:29][c:22]2[n:21]([CH3:20])[c:25]([N+:26](=[O:27])[O-:28])[cH:24][n:23]2)[n:17][n:18]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 312Chloride2×HCID 7918Acetic AnhydrideHCID 32051Zinc(2+)HCID 784871-Methyl-5-nitro-1H-imidazole-2-carbaldehydeHCID 233463742-Methyl-5-tridecyl-1,3,4-thiadiazole

Product 1

HCID 53739186HCID 53739186, compound

Sources & evidence

ORD record
ord-6fb3999c0b114573825e1dc77728c2b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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