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

Ethanol → 4-Chloro-3-(3,5-dichloro-pyridin-2-yl)-benzoic acid methyl ester

HRID 1549065
노트
인쇄 미리보기

반응식

HRID 1549065 반응식
[Br:1][c:2]1[n:3][cH:4][c:5]([Cl:9])[cH:6][c:7]1[Cl:8].[C:30](=[O:31])([O-:32])[O-:33].[CH2:36]([OH:37])[CH3:38].[CH3:10][O:11][C:12]([c:13]1[cH:14][c:15]([B:20]2[O:21][C:22]([CH3:23])([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28]2)[c:16]([Cl:19])[cH:17][cH:18]1)=[O:29].[Na+:34].[Na+:35].[c:39]1([CH3:40])[cH:41][cH:42][cH:43][cH:44][cH:45]1.[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[c:2]1(-[c:15]2[cH:14][c:13]([C:12]([O:11][CH3:10])=[O:29])[cH:18][cH:17][c:16]2[Cl:19])[n:3][cH:4][c:5]([Cl:9])[cH:6][c:7]1[Cl:8]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 702EthanolHCID 923Sodium Ion2회HCID 1140TolueneHCID 19660Carbonate IonHCID 8170902-Bromo-3,5-dichloropyridineHCID 20816364Methyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoateHCID 178420554
HCID 178420554, 화합물

생성물 1

HCID 686021224-Chloro-3-(3,5-dichloro-pyridin-2-yl)-benzoic acid methyl ester

출처 및 근거

ORD 기록
ord-21010ffe65ac44c4870a0f2525204f5e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트