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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 70951Generated: October 29, 2026

4-(Trifluoromethyl)benzenecarbothioyl chloride → HCID 86625564, compound

https://huagongshe.com/reaction/70951

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-(Trifluoromethyl)benzenecarbothioyl chlorideHCID 19862484—
Reactant2-Amino-3-(5,7-dichloro-4-fluoro-2H-benzotriazol-2-yl)-2-methylpropionitrileHCID 66619927—
ProductHCID 86625564HCID 86625564—

Reaction Steps

Using a procedure similar to that described in Example 1, except using 2-amino-3-(5,7-dichloro-4-fluoro-2H-benzotriazol-2-yl)-2-methylpropionitrile (90 mg, described in Example 46) and 4-trifluoromethylthiobenzoyl chloride (0.06 mL), the title compound was isolated as a white solid (95 mg, 62%). Rf=0.55 (1:1 EA/heptane). MS (ES): M/Z [M+H]=492. NMR: (400 MHz, DMSO-d6): 1.76 (s, 3H), 5.47 (d, J=13.3 Hz, 1H), 5.60 (d, J=13.3 Hz, 1H), 7.58-8.22 (m, 5H) and 8.94 (s, 1H). 19F NMR (376 MHz, DMSO-d6): −127.6 (d, J=5.3 Hz, 1F) and −42.0 (s, 3F).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08822689B2
Source datasetuspto-grants-2014_09
ORD IDord-fbd7e72676544726a286dda3512b4cac
Source noteuspto-grants-2014_09