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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1898341Generated: October 30, 2026

1,3-Dichloro-2-isothiocyanatobenzene → HCID 178496988, compound

https://huagongshe.com/reaction/1898341

Reaction equation

Participants

RoleNameHCIDCharge
Reactant1,3-Dichloro-2-isothiocyanatobenzeneHCID 123239—
ReactantMethyl 4,5-diamino-2-hydroxybenzoateHCID 67504371—
SolventAcetonitrileHCID 6342—
ProductHCID 178496988HCID 17849698852.2%

Reaction Steps

To a solution of methyl 4,5-diamino-2-hydroxybenzoate (0.500 g, 2.74 mmol) in acetonitrile (15.0 mL) was added 1,3-dichloro-2-isothiocyanatobenzene (Intermediate-5, 0.550 g, 2.72 mmol). The reaction mass was stirred at RT for 24 h and N,N-di-isopropyl carbodimide (1.0 mL) was added to it. The reaction mass stirred at RT for 4-6 h. The reaction mass was cooled and filtered to afford 0.500 g of the desired product. 1HNMR (DMSO-d6): δ 3.86 (s, 3H), 6.56 (s, 1H), 7.22 (t, J=7.8 Hz, 1H), 7.38 (s, 1H), 7.52 (d, J=7.8 Hz, 2H), 10.49-10.64 (s, 3H); MS [M+H]+: 352.08.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08519149B2
Source datasetuspto-grants-2013_08
ORD IDord-496fd3abfc944aa1ba959930318e0580
Source noteuspto-grants-2013_08