2-(2-{2-[2-(2-Methoxy-Ethoxy)-Ethoxy]-Ethoxy}-Ethoxy)-Ethanol

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as polyethylene glycols. These are oligomers or polymers of ethylene oxide, with the general formula (C2H4O)n (with n>=3).

Polyethylene glycols

Organic compounds

Organooxygen compounds

Ethers

Dialkyl ethers

Calculated Property

kind Value Source
logP -0.42 ALOGPS
logS -1.8 ALOGPS
Water Solubility 4.22e+00 g/l ALOGPS
logP -0.75 ChemAxon
IUPAC Name 2,5,8,11,14-pentaoxahexadecan-16-ol ChemAxon
Traditional IUPAC Name 2,5,8,11,14-pentaoxahexadecan-16-ol ChemAxon
Molecular Weight 252.3047 ChemAxon
Monoisotopic Weight 252.1572885 ChemAxon
SMILES COCCOCCOCCOCCOCCO ChemAxon
Molecular Formula C11H24O6 ChemAxon
InChI InChI=1S/C11H24O6/c1-13-4-5-15-8-9-17-11-10-16-7-6-14-3-2-12/h12H,2-11H2,1H3 ChemAxon
InChIKey InChIKey=SLNYBUIEAMRFSZ-UHFFFAOYSA-N ChemAxon
Polar Surface Area (PSA) 66.38 ChemAxon
Refractivity 63.48 ChemAxon
Polarizability 29.33 ChemAxon
Rotatable Bond Count 14 ChemAxon
H Bond Acceptor Count 6 ChemAxon
H Bond Donor Count 1 ChemAxon
pKa (strongest acidic) 15.12 ChemAxon
pKa (strongest basic) -2.7 ChemAxon
Physiological Charge 0 ChemAxon
Number of Rings 0 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 0 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • ActVA 6 protein : in Streptomyces coelicolor
  • mRNA interferase EndoA : in Bacillus subtilis (strain 168)