chempirical

Trilaurin

C39H74O6CAS 538-24-9639.02 g/mol

Open in Covalent MOL file
OOOOOO
Ester

Properties

Molecular formula
C39H74O6
Molar mass
639.02 g/mol
Exact mass
638.5485 Da
Melting point
45 °C
logP
11.75Crippen estimate
Polar surface area
78.9 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
35

Identifiers

CAS number
538-24-9
SMILES
CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC
InChIKey
VMPHSYLJUKZBJJ-UHFFFAOYSA-N
InChI
InChI=1S/C39H74O6/c1-4-7-10-13-16-19-22-25-28-31-37(40)43-34-36(45-39(42)33-30-27-24-21-18-15-12-9-6-3)35-44-38(41)32-29-26-23-20-17-14-11-8-5-2/h36H,4-35H2,1-3H3

Weigh it out

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

Names and synonyms

21 names · show all
  • Dodecanoic acid, 1,1′,1′′-(1,2,3-propanetriyl) ester
  • Laurin, tri-
  • Dodecanoic acid, 1,2,3-propanetriyl ester
  • Glyceryl trilaurate
  • Glycerol trilaurate
  • Lauric acid triglyceride
  • Lauric acid triglycerin ester
  • Glyceryl tridodecanoate
  • Glycerin trilaurate
  • Glyceryl laurate
  • Lauric triglyceride
  • Dynasan 112
  • Trilauroylglycerol
  • Tridodecanoin
  • Triglyceride LaLaLa
  • Glycerin tridodecanoate
  • Tridodecanoyl glycerol
  • NSC 4061
  • LaLaLa triacylglycerol
  • Glycerine trilaurate
  • 2,3-Di(dodecanoyloxy)propyl dodecanoate

Work with Trilaurin

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

Axona538-23-8100 % similar Stearin555-43-1100 % similar Tripalmitin555-44-2100 % similar Tricaprin621-71-6100 % similar Triolein122-32-785 % similar (±)-1,2-Dipalmitoylglycerol40290-32-279 % similar 1,2-Dioctanoyl-sn-glycerol60514-48-979 % similar Trihydroxystearin139-44-678 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook