Acetonitrile → methyl P-phenyl-2-nitro-5-(2-chloro-4-trifluoromethylphenoxy)phenylphosphinate

HRID 1147652

반응식

[CH3:36][C:37]#[N:38].[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([N+:14]([O-:15])=[O:16])[c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]2)[cH:17][cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]1.[c:25]1([P:31]([O:32][CH3:33])[O:34][CH3:35])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([P:31]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)([O:32][CH3:33])=[O:34])[c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]2)[cH:17][cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]1

참가 물질

반응물 3

HCID 6342Acetonitrile

HCID 76277Dimethyl phenylphosphonite

HCID 156238Benzene, 2-chloro-1-(3,4-dinitrophenoxy)-4-(trifluoromethyl)-

생성물 1

HCID 54521036methyl P-phenyl-2-nitro-5-(2-chloro-4-trifluoromethylphenoxy)phenylphosphinate

출처 및 근거

ORD 기록: ord-30d5726eb91f419b8ef8d08ddbd51b3c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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