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Potassium Cation → Methyl 2-(3-hydroxycyclohexyloxymethyl)-6-methylbenzoate

HRID 120086
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HRID 120086 반응식
[Br:15][CH2:16][c:17]1[c:18]([C:19](=[O:20])[O:21][CH3:22])[c:23]([CH3:27])[cH:24][cH:25][cH:26]1.[Br:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][c:34]([CH3:35])[c:36]1[C:37]([Br:38])=[O:39].[CH3:40][c:41]1[cH:42][cH:43][cH:44][c:45]([CH3:46])[c:47]1[C:48]([O:49][CH3:50])=[O:51].[CH3:52][N:53]1[CH2:54][CH2:55][CH2:56][C:57]1=[O:58].[CH3:9][C:10]([CH3:11])([O-:12])[CH3:13].[CH:1]1([OH:8])[CH2:2][CH:3]([OH:7])[CH2:4][CH2:5][CH2:6]1.[K+:14].[OH2:59]>>[CH:1]1([O:8][CH2:16][c:17]2[c:18]([C:19](=[O:20])[O:21][CH3:22])[c:23]([CH3:27])[cH:24][cH:25][cH:26]2)[CH2:2][CH:3]([OH:7])[CH2:4][CH2:5][CH2:6]1
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반응물 8

HCID 813Potassium CationHCID 962WaterHCID 104331,3-CyclohexanediolHCID 13387N-methyl-2-pyrrolidoneHCID 519028Methyl 2,6-dimethylbenzoateHCID 45749132-Methylpropan-2-olateHCID 10263795Methyl 2-(bromomethyl)-6-methylbenzoate
HCID 21980307
2-(Bromomethyl)-6-methylbenzoyl bromide

생성물 1

HCID 21980299Methyl 2-(3-hydroxycyclohexyloxymethyl)-6-methylbenzoate

출처 및 근거

ORD 기록
ord-a960614945b34562a2b66fbfc5a1610f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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