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Sodium Ion → 2-(4,4-Ethylenedioxy-4-phenylbutyl)-2-(1-naphthylmethyl)malonic acid diethyl ester

HRID 1129932
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반응식

HRID 1129932 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[CH2:11][c:12]1[cH:13][cH:14][cH:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]12)=[O:22].[CH2:25]1[O:26][C:27]([CH2:28][CH2:29][CH2:30][Br:31])([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[O:38][CH2:39]1.[CH3:41][O:42][CH2:43][CH2:44][O:45][CH3:46].[H-:23].[Na+:24].[OH2:40]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])([CH2:11][c:12]1[cH:13][cH:14][cH:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]12)[CH2:30][CH2:29][CH2:28][C:27]1([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[O:26][CH2:25][CH2:39][O:38]1)=[O:22]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 923Sodium IonHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 166653HydrideHCID 9972002Diethyl (1-naphthyl)methylmalonateHCID 147642024,4-Ethylenedioxy-4-phenylbutyl bromide

생성물 1

HCID 53868668
2-(4,4-Ethylenedioxy-4-phenylbutyl)-2-(1-naphthylmethyl)malonic acid diethyl ester

출처 및 근거

ORD 기록
ord-a2e09e062dc346f4af3c0cac5852013c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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