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Isopropanol → 7-chloro-N-(3-chloro-4-fluorophenyl)-6-nitro-4-quinazolinamine

HRID 191571
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HRID 191571 반응식
[CH3:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH:44]([OH:45])([CH3:46])[CH3:47].[Cl:16][c:17]1[c:18]([N+:19]([O-:20])=[O:21])[c:22]2[c:23]([c:24](=[O:25])[nH:26][cH:27][n:28]2)[cH:29][cH:30]1.[Cl:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[cH:4][c:5]2[c:6](=[O:12])[nH:7][cH:8][n:9][c:10]2[cH:11]1.[Cl:35][c:36]1[cH:37][c:38]([NH2:39])[cH:40][cH:41][c:42]1[F:43].[Cl:54][CH2:55][Cl:56].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[S:31]([Cl:32])([Cl:33])=[O:34]>>[Cl:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[cH:4][c:5]2[c:6]([NH:39][c:38]3[cH:37][c:36]([Cl:35])[c:42]([F:43])[cH:41][cH:40]3)[n:7][cH:8][n:9][c:10]2[cH:11]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 3776IsopropanolHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8058HexaneHCID 97083-Chloro-4-fluoroanilineHCID 24386Thionyl ChlorideHCID 1356875047-Chloro-6-nitro-4-quinazolinol
HCID 135738674
7-Chloro-8-nitro quinazolin-4(3h)-one

생성물 1

HCID 218478177-chloro-N-(3-chloro-4-fluorophenyl)-6-nitro-4-quinazolinamine

출처 및 근거

ORD 기록
ord-d6e16630104746b5a481e501faed704c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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