chempirical

3,6,9,12,15,18,21,24-Octaoxahexacosane-1,26-diol

C18H38O10CAS 3386-18-3414.49 g/mol

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AlcoholEther

Properties

Molecular formula
C18H38O10
Molar mass
414.49 g/mol
Exact mass
414.2465 Da
Melting point
24–25.2 °C
Boiling point
190 °C (at 0.01 Torr)
logP
-0.90Crippen estimate
Polar surface area
114.3 Ų
H-bond donors / acceptors
2 / 10
Rotatable bonds
25

Identifiers

CAS number
3386-18-3
SMILES
OCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChIKey
YZUUTMGDONTGTN-UHFFFAOYSA-N
InChI
InChI=1S/C18H38O10/c19-1-3-21-5-7-23-9-11-25-13-15-27-17-18-28-16-14-26-12-10-24-8-6-22-4-2-20/h19-20H,1-18H2

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Names and synonyms

3 names
  • Nonaethylene glycol
  • 2-[2-(2-[2-[2-(2-[2-[2-(2-Hydroxy-ethoxy)-ethoxy]-ethoxy]-ethoxy)-ethoxy]-ethoxy]-ethoxy)-ethoxy]-ethanol
  • 2-[2-[2-[2-[2-[2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Work with 3,6,9,12,15,18,21,24-Octaoxahexacosane-1,26-diol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Triethylene glycol112-27-6100 % similar Tetraethylene glycol112-60-7100 % similar Hexaethylene glycol2615-15-8100 % similar Pentaethylene glycol4792-15-8100 % similar Octaethylene glycol5117-19-1100 % similar Decaethylene glycol5579-66-8100 % similar Heptaethylene glycol5617-32-3100 % similar 3,6,9,12,15,18,21,24,27,30,33-Undecaoxapentatriacontane-1,35-diol6790-09-6100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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