O-Xylene → HCID 58778873, 화합물

반응식

[Cl:1][c:2]1[o:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][cH:9][cH:10]2.[NH2:11][c:12]1[c:13]([CH3:26])[cH:14][c:15]([CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[cH:16][cH:17]1.[c:27]1([CH3:28])[c:29]([CH3:30])[cH:31][cH:32][cH:33][cH:34]1>>[c:2]1([NH:11][c:12]2[c:13]([CH3:26])[cH:14][c:15]([CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[cH:16][cH:17]2)[o:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][cH:9][cH:10]2

참가 물질

반응물 3

HCID 7237O-Xylene

HCID 119862-Chlorobenzoxazole

HCID 23512173Tert-butyl 4-amino-3-methylphenylacetate

생성물 1

HCID 58778873HCID 58778873, 화합물

출처 및 근거

ORD 기록: ord-39608c54aa7d4544bd31842e6a348fbd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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