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Chemical Structure| 111-87-5 Chemical Structure| 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

Application In Synthesis of 1-Octanol

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Upstream synthesis route of [ 111-87-5 ]
  • Downstream synthetic route of [ 111-87-5 ]

[ 111-87-5 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 111-87-5 ]
  • [ 62-90-8 ]
References: [1] Patent: US3959322, 1976, A, .
 

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