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Hydrochloric Acid → (5-{2-[(Benzyl-cyclopropanecarbonyl-amino)-methyl]-4-cyano-phenyl}-pyridin-3-yl)-acetic acid ethyl ester

HRID 801998
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HRID 801998 반응식
[C:45](=[O:46])([O-:47])[O-:48].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9](=[O:10])[CH:11]1[CH2:12][CH2:13]1)[CH2:14][c:15]1[c:16]([B:23]2[O:24][C:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31]2)[cH:17][cH:18][c:19]([C:21]#[N:22])[cH:20]1.[CH2:32]([CH3:33])[O:34][C:35]([CH2:36][c:37]1[cH:38][n:39][cH:40][c:41]([Br:43])[cH:42]1)=[O:44].[CH3:51][O:52][CH2:53][CH2:54][O:55][CH3:56].[ClH:58].[K+:49].[K+:50].[OH2:57].[cH:59]1[cH:60][cH:61][c:62]([P:63]([Pd:64]([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([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)([P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([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)[P:103]([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)([c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)([c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[c:128]2[cH:129][cH:130][cH:131][cH:132][cH:133]2)[cH:134][cH:135]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9](=[O:10])[CH:11]1[CH2:12][CH2:13]1)[CH2:14][c:15]1[c:16](-[c:41]2[cH:40][n:39][cH:38][c:37]([CH2:36][C:35]([O:34][CH2:32][CH3:33])=[O:44])[cH:42]2)[cH:17][cH:18][c:19]([C:21]#[N:22])[cH:20]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric AcidHCID 813Potassium Cation2회HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 54116619Ethyl 2-(5-bromopyridin-3-yl)acetateHCID 67212390Cyclopropanecarboxylic acid benzyl-[5-cyano-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzyl]-amide
HCID 178420554HCID 178420554, 화합물

생성물 1

HCID 67212964(5-{2-[(Benzyl-cyclopropanecarbonyl-amino)-methyl]-4-cyano-phenyl}-pyridin-3-yl)-acetic acid ethyl ester

출처 및 근거

ORD 기록
ord-c9a4f13ebadb407ab52f7e3a18b4777a
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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