Acetic Acid → 1-(4-Methanesulfonyl-3-trifluoromethyl-phenyl)-propan-2-one

HRID 295372노트

반응식

HRID 295372 반응식
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:17]([F:18])([F:19])[F:20])[cH:7][c:8]([CH:11]=[C:12]([CH3:13])[N+:14]([O-:15])=[O:16])[cH:9][cH:10]1.[CH3:21][C:22]([OH:23])=[O:24].[Fe:25]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:17]([F:18])([F:19])[F:20])[cH:7][c:8]([CH2:11][C:12]([CH3:13])=[O:23])[cH:9][cH:10]1

참가 물질

4

반응물 3

HCID 176Acetic AcidHCID 23925IronHCID 673913281-Methanesulfonyl-4-(2-nitro-propenyl)-2-trifluoromethyl-benzene

생성물 1

HCID 673910181-(4-Methanesulfonyl-3-trifluoromethyl-phenyl)-propan-2-one

출처 및 근거

ORD 기록
ord-e5f97e759f384a5a958748f265b5b5c7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

반응 노트

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