Ethanol → 2-Phenylbenzothiazol-5-ol

HRID 292840Notes

Reaction equation

HRID 292840 reaction equation
[CH2:30]([OH:31])[CH3:32].[CH:24]1=[CH:29][CH2:28][CH2:27][CH2:26][CH2:25]1.[OH-:33].[OH-:35].[Pd+2:34].[c:1]1(-[c:7]2[s:8][c:9]3[c:10]([n:11]2)[cH:12][c:13]([O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[s:8][c:9]3[c:10]([n:11]2)[cH:12][c:13]([OH:16])[cH:14][cH:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 702EthanolHCID 961Hydroxide2×HCID 8079CyclohexeneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 22591632HCID 22591632, compound

Product 1

HCID 225916142-Phenylbenzothiazol-5-ol

Sources & evidence

ORD record
ord-3f680c1ca3b0438db68160bc7275c83f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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