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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2106235Generated: November 1, 2026

3,4-Dimethylbenzyl chloride → HCID 59752501, compound

https://huagongshe.com/reaction/2106235

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3,4-Dimethylbenzyl chlorideHCID 66018—
Reactant3-(4-chloro-phenyl)-4,5,7,8-tetrahydro-1H-1,2,6-triaza-azulene-6-carboxylic acid tert-butyl esterHCID 67269020—
ProductHCID 59752501HCID 59752501—

Reaction Steps

The title compound (0.003 g) was prepared from 3-(4-chloro-phenyl)-4,5,7,8-tetrahydro-1H-1,2,6-triaza-azulene-6-carboxylic acid tert-butyl ester (Example 59, Step C, 0.1 g) using 3,4-dimethylbenzyl chloride (0.6 mL) in place of benzyl chloride. MS (ESI): exact mass calculated for C22H24ClN3, 365.17; found, m/z 366.2 [M+H]+. 1H NMR (500 MHz, CD3OD): 7.40-7.38 (m, 2H), 7.35-7.32 (m, 2H), 6.98-6.96 (m, 1H), 6.90-6.86 (m, 1H), 6.72-6.69 (m, 1H), 5.30 (s, 1H), 5.19 (s, 1H), 2.90-2.87 (m, 2H), 2.86-2.82 (m, 2H), 2.77-2.73 (m, 2H), 2.72-2.68 (m, 2H), 2.21 (s, 3H), 2.17 (s, 3H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07579470B2
Source datasetuspto-grants-2009_08
ORD IDord-b04943f524434477a1d213ef0a56af60
Source noteuspto-grants-2009_08