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Hydrochloric Acid → (+/-)-4-Dodecyl-alpha-phenyl-N-(2,4,6-trimethoxyphenyl)-2H-1,2,3-triazole-2-acetamide

HRID 1224012
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HRID 1224012 반응식
[CH2:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH3:33])[c:34]1[n:35][n:36]([CH:39]([C:40](=[O:41])[OH:42])[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[n:37][cH:38]1.[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:9][O:10][c:11]1[c:12]([NH2:13])[c:14]([O:20][CH3:21])[cH:15][c:16]([O:18][CH3:19])[cH:17]1.[CH:49]1([N:50]=[C:51]=[N:52][CH:53]2[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]2)[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]1.[Cl:69][CH2:70][Cl:71].[ClH:8]>>[CH3:9][O:10][c:11]1[c:12]([NH:13][C:40]([CH:39]([n:36]2[n:35][c:34]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH3:33])[cH:38][n:37]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)=[O:41])[c:14]([O:20][CH3:21])[cH:15][c:16]([O:18][CH3:19])[cH:17]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 10868DicyclohexylcarbodiimideHCID 842712,4,6-TrimethoxyanilineHCID 21469537(+/-)-4-Dodecyl-alpha-phenyl-2H-1,2,3-triazole-2-acetic acid

생성물

1
HCID 21469571(+/-)-4-Dodecyl-alpha-phenyl-N-(2,4,6-trimethoxyphenyl)-2H-1,2,3-triazole-2-acetamide

출처 및 근거

ORD 기록
ord-21803fbbe9274751adefe96133dde411
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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