1-Chloro-4-isothiocyanato-2-(trifluoromethyl)benzene → HCID 57248043, compound

HRID 2395356Notes

Reaction equation

HRID 2395356 reaction equation
[N+:1]([C:4]1[C:13]([S:14][C:15]2[CH:20]=[CH:19][C:18]([NH2:21])=[CH:17][CH:16]=2)=[CH:12][CH:11]=[C:10]2[C:5]=1[CH:6]=[CH:7][CH:8]=[N:9]2)([O-:3])=[O:2].[Cl:22][C:23]1[CH:28]=[CH:27][C:26]([N:29]=[C:30]=[S:31])=[CH:25][C:24]=1[C:32]([F:35])([F:34])[F:33]>>[N+:1]([C:4]1[C:13]([S:14][C:15]2[CH:20]=[CH:19][C:18]([NH:21][C:30]([NH:29][C:26]3[CH:27]=[CH:28][C:23]([Cl:22])=[C:24]([C:32]([F:35])([F:33])[F:34])[CH:25]=3)=[S:31])=[CH:17][CH:16]=2)=[CH:12][CH:11]=[C:10]2[C:5]=1[CH:6]=[CH:7][CH:8]=[N:9]2)([O-:3])=[O:2]

Participants

3

Reactant 2

HCID 5200261-Chloro-4-isothiocyanato-2-(trifluoromethyl)benzeneHCID 18971640HCID 18971640, compound

Product 1

HCID 57248043HCID 57248043, compound

Procedure

5-nitro-6-(4-aminophenylthio)quinoline 1.7 mmoles, 0.40 g) and 4-chloro-3-trifluoromethylphenylisothiocyanate 1.7 mmoles, 0.47 g) were reacted according to procedure C to yield the title compound, 0.78 g, 86% product. Mass spec (FD) 534. Calculated for C23H14ClF3 N4O2S2 : C, 51.64; H, 2.64, N, 10.47 Found: C, 51.84; H, 2.73; N, 10.43.

Sources & evidence

ORD record
ord-2d052fb4c91f46089c759975c3ac8cb0
Source dataset
uspto-grants-1998_09
Patent number
US05814646

Reaction notes

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