chempirical

Decyl oleate

C28H54O2CAS 3687-46-5422.74 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C28H54O2
Molar mass
422.74 g/mol
Exact mass
422.4124 Da
Density
0.862 g/mL (at 20 °C)
Melting point
2.8 °C
logP
9.71Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
24

Identifiers

CAS number
3687-46-5
SMILES
CCCCCCCC/C=CCCCCCCCC(=O)OCCCCCCCCCC
InChIKey
SASYSVUEVMOWPL-NXVVXOECSA-N
InChI
InChI=1S/C28H54O2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28(29)30-27-25-23-21-12-10-8-6-4-2/h15-16H,3-14,17-27H2,1-2H3/b16-15-

Weigh it out

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

Names and synonyms

13 names · show all
  • 9-Octadecenoic acid (9Z)-, decyl ester
  • Oleic acid, decyl ester
  • 9-Octadecenoic acid (Z)-, decyl ester
  • Cetiol V
  • Ceraphyl 140
  • Standamul CTV
  • Oleic acid n-decyl ester
  • Tegosoft DO
  • Estol DCO 3662
  • Saboderm DO
  • Decyl cis-9-octadecenoate
  • Cetiol V-PH
  • Kollicream DO

Work with Decyl oleate

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

Butyl oleate142-77-893 % similar Dioctyl adipate123-79-583 % similar Decyl decanoate1654-86-083 % similar Dioctyl decanedioate2432-87-383 % similar Stearyl stearate2778-96-383 % similar Myristyl myristate3234-85-383 % similar Decyl laurate36528-28-683 % similar Dinonyl sebacate4121-16-883 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook