chempirical

Ethyl eicosanoate

C22H44O2CAS 18281-05-5340.59 g/mol

Open in Covalent MOL file
OO
Ester

Properties

Molecular formula
C22H44O2
Molar mass
340.59 g/mol
Exact mass
340.3341 Da
Melting point
50 °C
Boiling point
295 °C
logP
7.59Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
19

Identifiers

CAS number
18281-05-5
SMILES
CCCCCCCCCCCCCCCCCCCC(=O)OCC
InChIKey
YBKSMWBLSBAFBQ-UHFFFAOYSA-N
InChI
InChI=1S/C22H44O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h3-21H2,1-2H3

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

Names and synonyms

4 names
  • Eicosanoic acid, ethyl ester
  • Arachidic acid, ethyl ester
  • Ethyl arachate
  • Ethyl arachidate

Work with Ethyl eicosanoate

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

Ethyl heptanoate106-30-9100 % similar Ethyl octanoate106-32-1100 % similar Ethyl dodecanoate106-33-2100 % similar Ethyl decanoate110-38-3100 % similar Ethyl stearate111-61-5100 % similar Ethyl nonanoate123-29-5100 % similar Ethyl myristate124-06-1100 % similar Ethyl heptadecanoate14010-23-2100 % similar

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

Same formula

Behenic acid112-85-6 Butyl stearate123-95-5 Decyl laurate36528-28-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook