Dichloromethane → 7-Cyclopentyl-5-methoxy-2,2-dimethyl-6-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-4H-chromen-4-one

반응식

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

참가 물질

반응물 2

HCID 6344Dichloromethane

HCID 58002993HCID 58002993, 화합물

생성물 1

HCID 580029777-Cyclopentyl-5-methoxy-2,2-dimethyl-6-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-4H-chromen-4-one

출처 및 근거

ORD 기록: ord-099d028a5a1d4fce822d42f7c59081b3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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