chempirical

Dipropyl sebacate

C16H30O4CAS 15419-91-7286.41 g/mol

Open in Covalent MOL file
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Ester

Properties

Molecular formula
C16H30O4
Molar mass
286.41 g/mol
Exact mass
286.2144 Da
logP
4.01Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
13

Identifiers

CAS number
15419-91-7
SMILES
CCCOC(=O)CCCCCCCCC(=O)OCCC
InChIKey
UHGPEWTZABDZCE-UHFFFAOYSA-N
InChI
InChI=1S/C16H30O4/c1-3-13-19-15(17)11-9-7-5-6-8-10-12-16(18)20-14-4-2/h3-14H2,1-2H3

Weigh it out

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

Names and synonyms

5 names
  • Decanedioic acid, 1,10-dipropyl ester
  • Sebacic acid, dipropyl ester
  • Decanedioic acid, dipropyl ester
  • Dipropyl decanedioate
  • Nikkol DIS

Work with Dipropyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dipropyl adipate106-19-495 % similar Propyl heptanoate7778-87-292 % similar Propyl hexanoate626-77-788 % similar Dibutyl sebacate109-43-380 % similar Dibutyl azelate2917-73-980 % similar Glycol distearate627-83-880 % similar Dipropyl succinate925-15-578 % similar Butyl laurate106-18-377 % similar

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

Same formula

2,5-Dimethyl-2,5-di(tert-butylperoxy)hexyne-31068-27-5 Thapsic acid505-54-4 2,2,4-Trimethyl-1,3-pentanediol diisobutyrate6846-50-0 Diisopropyl sebacate7491-02-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook