Thiophene-3-boronic acid → 2,2-dimethyl-5-{4-(methylsulfonyl)phenyl}-4-(3-thienyl)-3(2H)-furanone

반응식

[Br:1][C:2]1=[C:6]([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[O:5][C:4]([CH3:17])([CH3:18])[C:3]1=[O:19].[s:20]1[cH:21][c:22]([B:25]([OH:26])[OH:27])[cH:23][cH:24]1>>[C:2]1([c:22]2[cH:21][s:20][cH:24][cH:23]2)=[C:6]([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[O:5][C:4]([CH3:17])([CH3:18])[C:3]1=[O:19]

참가 물질

반응물 2

HCID 581760Thiophene-3-boronic acid

HCID 183857274-Bromo-2,2-dimethyl-5-[4-(methylsulfonyl)phenyl]-3(2h)-furanone

생성물 1

HCID 117724242,2-dimethyl-5-{4-(methylsulfonyl)phenyl}-4-(3-thienyl)-3(2H)-furanone

출처 및 근거

ORD 기록: ord-39530cbe2dc64309a7cb84807aa6bf73
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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