chempirical

3,6,9,12,15,18,21,24,27,30,33-Undecaoxapentatriacontane-1,35-diol

C24H50O13CAS 6790-09-6546.65 g/mol

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AlcoholEther

Properties

Molecular formula
C24H50O13
Molar mass
546.65 g/mol
Exact mass
546.3251 Da
logP
-0.85Crippen estimate
Polar surface area
142.0 Ų
H-bond donors / acceptors
2 / 13
Rotatable bonds
34

Identifiers

CAS number
6790-09-6
SMILES
OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChIKey
WRZXKWFJEFFURH-UHFFFAOYSA-N
InChI
InChI=1S/C24H50O13/c25-1-3-27-5-7-29-9-11-31-13-15-33-17-19-35-21-23-37-24-22-36-20-18-34-16-14-32-12-10-30-8-6-28-4-2-26/h25-26H,1-24H2

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Names and synonyms

1 names
  • Dodecaethylene glycol

Work with 3,6,9,12,15,18,21,24,27,30,33-Undecaoxapentatriacontane-1,35-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 3,6,9,12,15,18,21,24-Octaoxahexacosane-1,26-diol3386-18-3100 % similar Pentaethylene glycol4792-15-8100 % similar Octaethylene glycol5117-19-1100 % similar Decaethylene glycol5579-66-8100 % similar Heptaethylene glycol5617-32-3100 % similar

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

Elsewhere

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