2-Ethylhexyl 3-mercaptopropionate → 2-Ethylhexyl 3-{[5-(benzyloxy)-2-nitrophenyl]sulfanyl}propanoate

HRID 677143

반응식

HRID 677143 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([F:18])[c:12]([N+:15](=[O:16])[O-:17])[cH:13][cH:14]1.[SH:19][CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH:26]([CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH3:32]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([S:19][CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH:26]([CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH3:32])[c:12]([N+:15](=[O:16])[O-:17])[cH:13][cH:14]1

참가 물질

3

반응물 2

HCID 926402-Ethylhexyl 3-mercaptopropionateHCID 221807044-Benzyloxy-2-fluoro-1-nitrobenzene

생성물 1

HCID 580473802-Ethylhexyl 3-{[5-(benzyloxy)-2-nitrophenyl]sulfanyl}propanoate

출처 및 근거

ORD 기록
ord-19a085f9081c460380d86380e7e5463b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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