Isobutyric Acid → 2-Isopropyl-1H-benzo[d]imidazol-5-amine

HRID 1549461

반응식

HRID 1549461 반응식
[CH3:27][CH:28]([C:29](=[O:30])[OH:31])[CH3:32].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[CH:12]([CH3:13])([CH3:14])[c:15]1[nH:16][c:17]2[c:18]([n:19]1)[cH:20][cH:21][c:22]([N+:24]([O-:25])=[O:26])[cH:23]2.[N+:1]([c:2]1[cH:3][cH:4][c:5]([NH2:6])[c:7]([NH2:8])[cH:9]1)([O-:10])=[O:11]>>[CH:12]([CH3:13])([CH3:14])[c:15]1[nH:16][c:17]2[c:18]([n:19]1)[cH:20][cH:21][c:22]([NH2:24])[cH:23]2

참가 물질

5

반응물 4

HCID 6590Isobutyric AcidHCID 8857Ethyl AcetateHCID 6832022-Isopropyl-5-nitro-1H-benzo[d]imidazoleHCID 51117914-Nitro-1,2-phenylenediamine

생성물 1

HCID 8207492-Isopropyl-1H-benzo[d]imidazol-5-amine

출처 및 근거

ORD 기록
ord-e6a0db4f6e544923857310ba9d6b9c47
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

연결된 노트

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