홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Water → Methyl {[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-nitro-5-(trifluoromethyl)benzyl]carbamate

HRID 301761
노트
인쇄 미리보기

반응식

HRID 301761 반응식
[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:36][CH3:37])[c:8](-[c:10]2[c:11]([CH2:20][NH:21][CH2:22][c:23]3[cH:24][c:25]([N+:33](=[O:34])[O-:35])[cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]3)[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:9]1.[CH:43]([N:44]([CH2:45][CH3:46])[CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51].[Cl:38][C:39](=[O:40])[O:41][CH3:42].[Cl:53][CH2:54][Cl:55].[OH2:52]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:36][CH3:37])[c:8](-[c:10]2[c:11]([CH2:20][N:21]([CH2:22][c:23]3[cH:24][c:25]([N+:33](=[O:34])[O-:35])[cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]3)[C:39](=[O:40])[O:41][CH3:42])[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:9]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 962WaterHCID 6344DichloromethaneHCID 6586Methyl chloroformateHCID 81531DiisopropylethylamineHCID 59343863{[5'-Isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-nitro-5-(trifluoromethyl)benzyl]amine

생성물 1

HCID 11534401
Methyl {[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-nitro-5-(trifluoromethyl)benzyl]carbamate

출처 및 근거

ORD 기록
ord-1daef39a5ac148f48e847be27c431ede
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트