chempirical

Methyl laurate

C13H26O2CAS 111-82-0214.35 g/mol

Open in Covalent MOL file
OO
Ester

Properties

Molecular formula
C13H26O2
Molar mass
214.35 g/mol
Exact mass
214.1933 Da
Density
0.8702 g/mL (at 20 °C)
Melting point
5.2 °C
Boiling point
267 °C
Water solubility
miscible
logP
4.08Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
10

Hazards

Warning
Environmental Hazard (GHS09)

Aggregated from 426 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number
111-82-0
SMILES
CCCCCCCCCCCC(=O)OC
InChIKey
UQDUPQYQJKYHQI-UHFFFAOYSA-N
InChI
InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3

Weigh it out

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

Names and synonyms

21 names · show all
  • Dodecanoic acid, methyl ester
  • Lauric acid, methyl ester
  • Metholene 2296
  • Methyl dodecanoate
  • Methyl laurinate
  • Uniphat A 40
  • Methyl dodecylate
  • Methyl n-dodecanoate
  • Stepan C 40
  • CE 1295
  • Pastell M 12
  • Emery 2296
  • Texaprint SDM 100
  • CE 1290
  • Edenor ME-C 1298-100
  • NSC 5027
  • Agnique ME 1270U
  • Agnique ME 1290
  • Agnique ME 1298
  • Exceparl ML 85
  • Radia 7118

Work with Methyl laurate

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

Methyl heptanoate106-73-0100 % similar Methyl decanoate110-42-9100 % similar Methyl octanoate111-11-5100 % similar Methyl palmitate112-39-0100 % similar Methyl stearate112-61-8100 % similar Methyl eicosanoate1120-28-1100 % similar Methyl myristate124-10-7100 % similar Methyl nonanoate1731-84-6100 % similar

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

Same formula

Isoamyl octanoate2035-99-6 Ethyl undecanoate627-90-7 Pentyl octanoate638-25-5 Tridecylic acid638-53-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook