Acetic Acid → Ethyl 5-(4-tert-butylphenyl)-4-chloroisoxazole-3-carboxylate

HRID 311754Notes

Reaction equation

HRID 311754 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][c:13]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:14][o:15]2)[cH:9][cH:10]1.[CH3:29][C:30](=[O:31])[OH:32].[Cl:21][N:22]1[C:23](=[O:24])[CH2:25][CH2:26][C:27]1=[O:28]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12]([Cl:21])[c:13]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:14][o:15]2)[cH:9][cH:10]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 31398ChlorosuccinimideHCID 20534825Ethyl 5-(4-tert-butylphenyl)-1,2-oxazole-3-carboxylate

Product 1

HCID 67121140Ethyl 5-(4-tert-butylphenyl)-4-chloroisoxazole-3-carboxylate

Sources & evidence

ORD record
ord-33a7ce7d4b5f4b5ab8ad352060f23c72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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