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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1624052Generated: November 1, 2026

HCID 178423753, compound → (cis)-4-[7-methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrile

https://huagongshe.com/reaction/1624052

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHCID 178423753HCID 178423753—
ReactantHCID 178461186HCID 178461186—
SolventEthanolHCID 702—
Product(cis)-4-[7-methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrileHCID 178461185—

Reaction Steps

(+/−)-(cis/trans)-4-[7-Methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrile (0.36 g, 1.52 mmol) and (+/−)-(trans)-4-[7-methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrile (0.18 g, 0.76 mmol) are combined and the single enantiomers are obtained by chiral chromatography (Chiralpak AD-H, 4.6×150 mm, 100% EtOH 0.2% DMEA, 225 mm) to give (cis)-4-[7-methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrile-isomer 2, (0.05 g, 27%) as the second eluting isomer. ES/MS m/z 238 (M+H), Tr=2.988 min. (trans)-4-[7-Methyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]benzonitrile-isomer 4, Example 61 (0.07 g, 19%). ES/MS m/z 238 (M+H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08778984B2
Source datasetuspto-grants-2014_07
ORD IDord-8f9eb791cc60452ea1437e58a1853fba
Source noteuspto-grants-2014_07