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Dichloromethane → (4'-{1-Ethyl-1-[4-(3-hydroxy-4,4-dimethyl-pentyl)-3-methyl-phenyl]-propyl}-2'-methyl-biphenyl-4-yl)acetic acid methyl ester

HRID 97134
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반응식

HRID 97134 반응식
[CH3:8][O:9][C:10]([CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19]([CH3:51])[cH:20][c:21]([C:24]([CH2:25][CH3:26])([CH2:27][CH3:28])[c:29]3[cH:30][c:31]([CH3:50])[c:32]([CH2:35][CH2:36][CH:37]([C:38]([CH3:39])([CH3:40])[CH3:41])[O:42][Si:43]([C:44]([CH3:45])([CH3:46])[CH3:47])([CH3:48])[CH3:49])[cH:33][cH:34]3)[cH:22][cH:23]2)[cH:16][cH:17]1)=[O:52].[Cl:53][CH2:54][Cl:55].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[CH3:8][O:9][C:10]([CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19]([CH3:51])[cH:20][c:21]([C:24]([CH2:25][CH3:26])([CH2:27][CH3:28])[c:29]3[cH:30][c:31]([CH3:50])[c:32]([CH2:35][CH2:36][CH:37]([C:38]([CH3:39])([CH3:40])[CH3:41])[OH:42])[cH:33][cH:34]3)[cH:22][cH:23]2)[cH:16][cH:17]1)=[O:52]
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참가 물질

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반응물 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 57709155[4'-(1-{4-[3-(t-butyl-dimethyl-silanyloxy)-4,4-dimethyl-pentyl]-3-methyl-phenyl}-1-ethyl-propyl)-2'-methyl-biphenyl-4-yl]-acetic Acid Methyl Ester

생성물 1

HCID 57708942(4'-{1-Ethyl-1-[4-(3-hydroxy-4,4-dimethyl-pentyl)-3-methyl-phenyl]-propyl}-2'-methyl-biphenyl-4-yl)acetic acid methyl ester

출처 및 근거

ORD 기록
ord-d00193a645234ab4a5db0280e198c08b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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