4'-(2H11)Pentyl-4-biphenylcarbonitrile

Modify Date: 2025-08-26 00:52:56

4'-(2H11)Pentyl-4-biphenylcarbonitrile Structure
4'-(2H11)Pentyl-4-biphenylcarbonitrile structure
Common Name 4'-(2H11)Pentyl-4-biphenylcarbonitrile
CAS Number 57078-20-3 Molecular Weight 260.418
Density 1.0±0.1 g/cm3 Boiling Point 361.6±0.0 °C at 760 mmHg
Molecular Formula C18H8D11N Melting Point N/A
MSDS N/A Flash Point 193.5±17.3 °C

 Use of 4'-(2H11)Pentyl-4-biphenylcarbonitrile


4'-Pentyl-[1,1'-biphenyl]-4-carbonitrile-d11 is the deuterium labeled 4'-Pentyl-[1,1'-biphenyl]-4-carbonitrile[1].

 Names

Name 4-cyano-4'-pentyl-d11-diphenyl
Synonym More Synonyms

 4'-(2H11)Pentyl-4-biphenylcarbonitrile Biological Activity

Description 4'-Pentyl-[1,1'-biphenyl]-4-carbonitrile-d11 is the deuterium labeled 4'-Pentyl-[1,1'-biphenyl]-4-carbonitrile[1].
Related Catalog
In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.  

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 361.6±0.0 °C at 760 mmHg
Molecular Formula C18H8D11N
Molecular Weight 260.418
Flash Point 193.5±17.3 °C
Exact Mass 260.220795
PSA 23.79000
LogP 5.88
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.569
InChIKey HHPCNRKYVYWYAU-GILSBCIXSA-N
SMILES CCCCCc1ccc(-c2ccc(C#N)cc2)cc1

 Synonyms

4'-(H)Pentylbiphenyl-4-carbonitrile
N-pentyl-N'-phenylpiperazine
4'-undecadeuteriopentyl-biphenyl-4-carbonitrile
4-n-pentyl-4'-cyanobiphenyl-d11
4-n-pentyl-1-phenylpiperazine
4'-(H)Pentyl-4-biphenylcarbonitrile
4-cyano-4'-n-pentyl-d11-biphenyl
[1,1'-Biphenyl]-4-carbonitrile, 4'-(pentyl-d)-
Piperazine,1-pentyl-4-phenyl
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