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Chemical Structure| 111-87-5 Chemical Structure| 111-87-5

Structure of 1-Octanol
CAS No.: 111-87-5

Chemical Structure| 111-87-5

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1-Octanol (Octanol), a saturated fatty alcohol, is a T-type calcium channels (T-channels) inhibitor with an IC50 of 4 μM for native T-currents. 1-Octanol is a highly attractive biofuel with diesel-like properties.

Synonyms: Octanol

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Product Citations

Product Citations

Cure, Hannah L ; Shell, Thomas A ;

Abstract: Substituting hydrogen atoms with fluorine alters physicochemical properties often resulting in improved drug action relative to the parent molecule. The high electronegativity of fluorine changes the electron density distribution of the molecule; however, the substitution does not significantly change the size of the molecule because hydrogen and fluorine have similar atomic radii. A trifluoroacetamido derivative (TFA-phenacetin) of phenacetin, an analgesic antipyretic drug, was synthesized to compare its lipophilicity to the parent molecule by determining octanol–water partition coefficients. TFA-phenacetin is over seven times more lipophilic than phenacetin, which suggests that TFA-phenacetin would have better bioavailability relative to phenacetin. The kinetics of cytochromes P-450 (CYP) catalyzed oxidation of phenacetin and TFA-phenacetin were compared using Sprague Dawley (SD) rat liver microsomes. Phenacetin and TFA-phenacetin have the same apparent binding affinity for the SD rat liver microsome CYP proteome and undergo CYP catalyzed oxidation at the same rate in the presence of SD rat liver microsomes.

Keywords: Phenacetin ; Fluorine derivative ; Lipophilicity

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Product Details of 1-Octanol

CAS No. :111-87-5
Formula : C8H18O
M.W : 130.23
SMILES Code : CCCCCCCCO
Synonyms :
Octanol
MDL No. :MFCD00002988
InChI Key :KBPLFHHGFOOTCA-UHFFFAOYSA-N
Pubchem ID :957

Safety of 1-Octanol

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H227-H319-H402-H412
Precautionary Statements:P210-P264-P273-P280-P305+P351+P338-P337+P313-P370+P378-P403+P235-P501

Isoform Comparison

Biological Activity

Clinical Trial:

NCT Number Conditions Phases Recruitment Completion Date Locations
NCT00016679 Essential Tremor PHASE1 COMPLETED 2025-03-04 National Institute of Neurolog... More >>ical Disorders and Stroke (NINDS), Bethesda, Maryland, 20892, United States Less <<
NCT00080366 Essential Tremor PHASE2 COMPLETED 2025-03-07 National Institutes of Health ... More >>Clinical Center, 9000 Rockville Pike, Bethesda, Maryland, 20892, United States Less <<
NCT00102596 Essential Tremor PHASE2 COMPLETED 2025-09-09 National Institutes of Health ... More >>Clinical Center, 9000 Rockville Pike, Bethesda, Maryland, 20892, United States Less <<
NCT00001986 Essential Tremor PHASE1 COMPLETED 2025-01-01 National Institute of Neurolog... More >>ical Disorders and Stroke (NINDS), Bethesda, Maryland, 20892, United States Less <<

Protocol

Bio Calculators
Preparing Stock Solutions 1mg 5mg 10mg

1 mM

5 mM

10 mM

7.68mL

1.54mL

0.77mL

38.39mL

7.68mL

3.84mL

76.79mL

15.36mL

7.68mL

Dissolving Methods
Please choose the appropriate dissolution scheme according to your animal administration guide.For the following dissolution schemes, clear stock solution should be prepared according to in vitro experiments, and then cosolvent should be added in turn:

in order to ensure the reliability of the experimental results, the clarified stock solution can be properly preserved according to the storage conditions; The working fluid for in vivo experiment is recommended to be prepared now and used on the same day;

The percentage shown in front of the following solvent refers to the volume ratio of the solvent in the final solution; If precipitation or precipitation occurs in the preparation process, it can be assisted by heating and/or ultrasound.
Protocol 1
Protocol 2

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