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Water → 4-Chloro-N-methyl-3-nitro-N-octadecylbenzamide

HRID 193499
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인쇄 미리보기

반응식

HRID 193499 반응식
[CH3:18][C:19]#[N:20].[CH3:21][NH:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH:41]([Cl:42])([Cl:43])[Cl:44].[N+:5](=[O:6])([O-:7])[c:8]1[cH:9][c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][c:16]1[Cl:17].[OH2:45].[S:1]([Cl:2])([Cl:3])=[O:4]>>[N+:5](=[O:6])([O-:7])[c:8]1[cH:9][c:10]([C:11](=[O:13])[N:22]([CH3:21])[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])[cH:14][cH:15][c:16]1[Cl:17]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 962WaterHCID 6212ChloroformHCID 6342AcetonitrileHCID 73204-Chloro-3-nitrobenzoic acidHCID 8471TriethylamineHCID 24386Thionyl ChlorideHCID 75539N-Methyloctadecylamine

생성물 1

HCID 14323647
4-Chloro-N-methyl-3-nitro-N-octadecylbenzamide

출처 및 근거

ORD 기록
ord-7f7c6e10702945d7b3e0fcbbb6706bf5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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