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Methanol → 4-Fluoro-N-[3-(4-isopropylphenyl)-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl]benzamide

HRID 96288
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반응식

HRID 96288 반응식
[C:41]([O:42][CH2:43][CH3:44])(=[O:45])[CH3:46].[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[CH3:47][OH:48].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:23])([CH3:24])[O:12][c:13]3[c:14]2[c:15]([CH3:22])[c:16]([NH2:21])[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1.[F:25][c:26]1[cH:27][cH:28][c:29]([C:30](=[O:31])[Cl:32])[cH:33][cH:34]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:23])([CH3:24])[O:12][c:13]3[c:14]2[c:15]([CH3:22])[c:16]([NH:21][C:30]([c:29]2[cH:28][cH:27][c:26]([F:25])[cH:34][cH:33]2)=[O:31])[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1
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반응물 5

HCID 887MethanolHCID 8058HexaneHCID 8857Ethyl AcetateHCID 678794-Fluorobenzoyl chlorideHCID 105199783-(4-Isopropylphenyl)-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-amine

생성물 1

HCID 219613164-Fluoro-N-[3-(4-isopropylphenyl)-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl]benzamide

출처 및 근거

ORD 기록
ord-2cc521f0df3d43588e4db1f32cd17c69
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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