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Dichloromethane → 2-(4-{1-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}phenoxy)ethyl methanesulfonate

HRID 701530
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HRID 701530 반응식
[CH3:1][S:2]([Cl:3])(=[O:4])=[O:5].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:42][CH2:43][Cl:44].[F:6][C:7]([c:8]1[n:9][n:10][c:11]2[n:12]1[n:13][c:14]([N:17]1[CH2:18][CH2:19][CH:20]([c:23]3[cH:24][cH:25][c:26]([O:27][CH2:28][CH2:29][OH:30])[cH:31][cH:32]3)[CH2:21][CH2:22]1)[cH:15][cH:16]2)([F:33])[F:34]>>[CH3:1][S:2](=[O:4])(=[O:5])[O:30][CH2:29][CH2:28][O:27][c:26]1[cH:25][cH:24][c:23]([CH:20]2[CH2:19][CH2:18][N:17]([c:14]3[n:13][n:12]4[c:8]([C:7]([F:6])([F:33])[F:34])[n:9][n:10][c:11]4[cH:16][cH:15]3)[CH2:22][CH2:21]2)[cH:32][cH:31]1
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반응물 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 667882562-(4-{1-[3-(Trifluoromethyl) [1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}phenoxy)ethanol

생성물 1

HCID 866466942-(4-{1-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}phenoxy)ethyl methanesulfonate

출처 및 근거

ORD 기록
ord-ca6f55200e33402c960fe420d9917d5b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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