Tetrahydrofuran → Ethyl {[2-methyl-4-({1-[4'-(trifluoromethyl)-4-biphenylyl]pentyl}oxy)phenyl]oxy}acetate

HRID 295561

반응식

HRID 295561 반응식
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([CH:15]([CH2:16][CH2:17][CH2:18][CH3:19])[OH:20])[cH:13][cH:14]2)[cH:7][cH:8]1)([F:21])[F:22].[OH:23][c:24]1[cH:25][c:26]([CH3:37])[c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:35][cH:36]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([CH:15]([CH2:16][CH2:17][CH2:18][CH3:19])[O:20][c:24]3[cH:25][c:26]([CH3:37])[c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:35][cH:36]3)[cH:13][cH:14]2)[cH:7][cH:8]1)([F:21])[F:22]

참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 21986458Ethyl (4-hydroxy-2-methylphenoxy)acetateHCID 596742571-[4'-(Trifluoromethyl)-4-biphenylyl]-1-pentanol

생성물 1

HCID 86604657Ethyl {[2-methyl-4-({1-[4'-(trifluoromethyl)-4-biphenylyl]pentyl}oxy)phenyl]oxy}acetate

출처 및 근거

ORD 기록
ord-9705163ebaa346a69dd4eb8dd6c6f8a3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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