Hydrochloric Acid → Ethyl 3-(4-aminocyclohex-1-enyl)benzoate

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 312751,4-Dioxane

HCID 67548489Ethyl 3-(4-tert-butoxycarbonylaminocyclohex-1-enyl)benzoate

생성물 1

HCID 67549303Ethyl 3-(4-aminocyclohex-1-enyl)benzoate

출처 및 근거

ORD 기록: ord-a67ba97ee598487c9815fdcf17a309f2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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