CAS 202480-75-9|2-(2H5)Ethyl(2H12)hexan-1-ol

Introduction:Basic information about CAS 202480-75-9|2-(2H5)Ethyl(2H12)hexan-1-ol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name2-(2H5)Ethyl(2H12)hexan-1-ol
CAS Number202480-75-9Molecular Weight147.333
Density0.8±0.1 g/cm3Boiling Point184.6±0.0 °C at 760 mmHg
Molecular FormulaC8HD17OMelting Point/
MSDS/Flash Point77.2±0.0 °C

Names

Name2-ethylhexyl-d17 alcohol
SynonymMore Synonyms

2-(2H5)Ethyl(2H12)hexan-1-ol BiologicalActivity

Description2-Ethylhexan-1-ol-d17 is the deuterium labeled 2-Ethylhexan-1-ol[1].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
In VitroStable 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

Density0.8±0.1 g/cm3
Boiling Point184.6±0.0 °C at 760 mmHg
Molecular FormulaC8HD17O
Molecular Weight147.333
Flash Point77.2±0.0 °C
Exact Mass147.242477
PSA20.23000
LogP2.82
Vapour Pressure0.2±0.7 mmHg at 25°C
Index of Refraction1.426
InChIKeyYIWUKEYIRIRTPP-MMDJZGHJSA-N
SMILESCCCCC(CC)CO
Storage condition2-8°C

Synonyms

2-(H)Ethyl(H)hexan-1-ol
1-Hexan-1,1,2,3,3,4,4,5,5,6,6,6-d-ol, 2-(ethyl-d)-
2-(H)Ethyl-1-(H)hexanol
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