Acetic Acid → 2-(4-Methylphenyl)-1,3-benzoxazol-5-amine

반응식

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

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 8857Ethyl Acetate

HCID 802799HCID 802799, 화합물

생성물 1

HCID 7218792-(4-Methylphenyl)-1,3-benzoxazol-5-amine

출처 및 근거

ORD 기록: ord-e9c800969c184b8fbf6be254d9497f3d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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