Chloride → Methyl 2-chloro-4-methylbenzo[d]thiazole-5-carboxylate

HRID 1230490Notes

Reaction equation

HRID 1230490 reaction equation
[CH2:18]1[O:19][CH2:20][CH2:21][O:22][CH2:23][CH2:24][O:25][CH2:26][CH2:27][O:28][CH2:29][CH2:30][O:31][CH2:32]1.[CH3:40][C:41]#[N:42].[Cl-:17].[Cl:43][Cu:44].[N:33]([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39].[NH2:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[c:7]([CH3:15])[c:8]([C:11](=[O:12])[O:13][CH3:14])[cH:9][cH:10]2.[Na+:16].[OH2:45]>>[c:2]1([Cl:17])[s:3][c:4]2[c:5]([n:6]1)[c:7]([CH3:15])[c:8]([C:11](=[O:12])[O:13][CH3:14])[cH:9][cH:10]2

Participants

9

Reactant 8

HCID 312ChlorideHCID 923Sodium ionHCID 962WaterHCID 6342AcetonitrileHCID 10906Tert-Butyl nitriteHCID 3633615-Crown-5HCID 62652Cuprous chlorideHCID 22390084Methyl 2-amino-4-methylbenzo[d]thiazole-5-carboxylate

Product 1

HCID 22390080Methyl 2-chloro-4-methylbenzo[d]thiazole-5-carboxylate

Sources & evidence

ORD record
ord-6d434c66a86749efb17df14a89534f6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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