Dichloromethane → 5-Amino-3-cyano-1-(2,6-dichloro-4-trifluoromethoxyphenyl)-4-ethynylpyrazole

반응식

[Cl:28][CH2:29][Cl:30].[NH2:1][c:2]1[c:3]([C:22]#[C:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[c:4]([C:20]#[N:21])[n:5][n:6]1-[c:7]1[c:8]([Cl:19])[cH:9][c:10]([O:14][C:15]([F:16])([F:17])[F:18])[cH:11][c:12]1[Cl:13].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1>>[NH2:1][c:2]1[c:3]([C:22]#[CH:23])[c:4]([C:20]#[N:21])[n:5][n:6]1-[c:7]1[c:8]([Cl:19])[cH:9][c:10]([O:14][C:15]([F:16])([F:17])[F:18])[cH:11][c:12]1[Cl:13]

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 8028Tetrahydrofuran

HCID 211881085-Amino-3-cyano-1-(2,6-dichloro-4-trifluoromethoxyphenyl)-4-trimethylsilylethynylpyrazole

생성물 1

HCID 211880625-Amino-3-cyano-1-(2,6-dichloro-4-trifluoromethoxyphenyl)-4-ethynylpyrazole

출처 및 근거

ORD 기록: ord-9eabd615920d4eedb6208255fc717d0b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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