1,2-Dichloroethane → 7-{2,6-Difluoro-4-[(3-methyl-butylamino)-methyl]-phenoxy}-2,2-dimethyl-benzo[1,3]dioxin-4-one

HRID 87870

Reaktionsgleichung

[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[CH3:1][C:2]1([CH3:24])[O:3][c:4]2[c:5]([cH:9][cH:10][c:11]([O:13][c:14]3[c:15]([F:23])[cH:16][c:17]([CH:18]=[O:19])[cH:20][c:21]3[F:22])[cH:12]2)[C:6](=[O:8])[O:7]1.[CH3:25][CH:26]([CH2:27][CH2:28][NH2:29])[CH3:30].[Cl:47][CH2:48][CH2:49][Cl:50].[K+:46].[Na+:44].[OH-:45]>>[CH3:1][C:2]1([CH3:24])[O:3][c:4]2[c:5]([cH:9][cH:10][c:11]([O:13][c:14]3[c:15]([F:23])[cH:16][c:17]([CH2:18][NH:29][CH2:28][CH2:27][CH:26]([CH3:25])[CH3:30])[cH:20][c:21]3[F:22])[cH:12]2)[C:6](=[O:8])[O:7]1

Komponenten

Edukt 7

HCID 111,2-Dichloroethane

HCID 813Potassium Cation

HCID 923Sodium ion

HCID 961Hydroxide

HCID 7894Isoamylamine

HCID 2724942Triacetoxyborohydride

HCID 579390244-(2,2-Dimethyl-4-oxo-4H-benzo[1,3]dioxin-7-yloxy)-3,5-difluoro-benzaldehyde

Produkt 1

HCID 579390267-{2,6-Difluoro-4-[(3-methyl-butylamino)-methyl]-phenoxy}-2,2-dimethyl-benzo[1,3]dioxin-4-one

Quellen und Nachweise

ORD-Eintrag: ord-ed45d5f4405a4901aaba06120b2971dc
Quelldatensatz: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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