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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19088086Generated: October 26, 2026

5-(2,5-Dimethoxy-3,4,6-trimethylphenyl)-5-phenylvaleronitrile

https://huagongshe.com/en/chemical/19088086

5-(2,5-Dimethoxy-3,4,6-trimethylphenyl)-5-phenylvaleronitrile molecular structure

Identifiers & Physical Properties

Molecular formulaC22H27NO2
Average molar mass337.5 g/mol
SMILESCOc1c(C)c(C)c(OC)c(C(CCCC#N)c2ccccc2)c1C
InChIKeyUTAXULNBXPDBTP-UHFFFAOYSA-N
PubChem CID19088086

Chemical & Physical Properties

XLogP5.3
Topological polar surface area42.3
Hydrogen bond donors0
Hydrogen bond acceptors3
Rotatable bonds7
Heavy atoms25
Formal charge0
Complexity437