Chloride → HCID 19430939, 화합물

반응식

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

참가 물질

반응물 3

HCID 312Chloride

HCID 47799Cyclobutanecarboxylic acid, 3-pentyl-

HCID 194309523,3'-Difluoro-4-hydroxy-4'-hexyloxybiphenyl

생성물 1

HCID 19430939HCID 19430939, 화합물

출처 및 근거

ORD 기록: ord-354e14efb351413eb7e866cbe9e66a8a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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