Chloroacetone → 3-(2-oxopropyl)-1,2,3,4-tetrahydro-5H-chromeno[3,4-c]pyridin-5-one

반응식

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

참가 물질

반응물 3

HCID 6571Chloroacetone

HCID 8471Triethylamine

HCID 131369221,2,3,4-Tetrahydro-5H-[1]benzopyrano[3,4-c]pyridin-5-one

생성물 1

HCID 131369403-(2-oxopropyl)-1,2,3,4-tetrahydro-5H-chromeno[3,4-c]pyridin-5-one

출처 및 근거

ORD 기록: ord-9605f0cd89f74c4ca7cd772cbbe9da04
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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