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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1898308Generated: October 27, 2026

2-Chloro-6-Methylphenyl Isothiocyanate → HCID 178496983, compound

https://huagongshe.com/reaction/1898308

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-Chloro-6-Methylphenyl IsothiocyanateHCID 3731725—
ReactantMethyl 4,5-diamino-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carboxylateHCID 67503724—
SolventAcetonitrileHCID 6342—
ProductHCID 178496983HCID 17849698351%

Reaction Steps

The title compound was prepared following the procedure described for Step-1 of Intermediate-3 using methyl 4,5-diamino-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carboxylate (Intermediate-1, 0.600 g, 2.54 mmol), acetonitrile (10.0 mL), 1-chloro-2-isothiocyanato-3-methylbenzene (Intermediate-34, 0.500 g, 2.73 mmol) and N,N-di-isopropyl carbodimide (0.300 g) to afford 0.500 g of the desired product. 1HNMR (DMSO-d6): δ 1.42 (s, 6H), 2.23 (s, 3H), 2.98 (s, 2H), 3.71 (s, 3H), 7.02 (d, J=7.5 Hz, 1H), 7.23-7.41 (m, 3H), 9.00 (s, 1H), 10.82 (s, 1H); MS [M+H]+: 386.32.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08519149B2
Source datasetuspto-grants-2013_08
ORD IDord-f095d5ae8b8a438eac4a9ecfb78dbcd2
Source noteuspto-grants-2013_08