chempirical

Dibutyl sebacate

C18H34O4CAS 109-43-3314.47 g/mol

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Ester

Properties

Molecular formula
C18H34O4
Molar mass
314.47 g/mol
Exact mass
314.2457 Da
Density
0.9405 g/mL (at 15 °C)
Melting point
−10 °C
Boiling point
344.5 °C
logP
4.79Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
15

Identifiers

CAS number
109-43-3
SMILES
CCCCOC(=O)CCCCCCCCC(=O)OCCCC
InChIKey
PYGXAGIECVVIOZ-UHFFFAOYSA-N
InChI
InChI=1S/C18H34O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3-16H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

16 names · show all
  • Decanedioic acid, 1,10-dibutyl ester
  • Sebacic acid, dibutyl ester
  • Decanedioic acid, dibutyl ester
  • PX 404
  • Bis(n-butyl) sebacate
  • Polycizer DBS
  • Staflex DBS
  • Kodaflex DBS
  • Di-n-Butyl sebacate
  • Ergoplast SDB
  • Dibutyl decanedioate
  • Sebacic acid di-n-butyl ester
  • Uniflex DBS
  • DBS
  • Reomol DBS
  • NSC 3893

Work with Dibutyl sebacate

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dibutyl azelate2917-73-9100 % similar Butyl laurate106-18-396 % similar Butyl myristate110-36-196 % similar Butyl palmitate111-06-896 % similar Butyl stearate123-95-596 % similar Butyl decanoate30673-36-096 % similar Butyl octanoate589-75-396 % similar Dibutyl adipate105-99-796 % similar

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

Same formula

3,5,5-Trimethylhexanoyl peroxide3851-87-4 Octadecanedioic acid871-70-5

Elsewhere

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