chempirical

Diethyl azelate

C13H24O4CAS 624-17-9244.33 g/mol

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Ester

Properties

Molecular formula
C13H24O4
Molar mass
244.33 g/mol
Exact mass
244.1675 Da
Melting point
−18.5 °C
Boiling point
291.5 °C
logP
2.84Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
10

Identifiers

CAS number
624-17-9
SMILES
CCOC(=O)CCCCCCCC(=O)OCC
InChIKey
CQMYCPZZIPXILQ-UHFFFAOYSA-N
InChI
InChI=1S/C13H24O4/c1-3-16-12(14)10-8-6-5-7-9-11-13(15)17-4-2/h3-11H2,1-2H3

Weigh it out

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

Names and synonyms

6 names
  • Nonanedioic acid, 1,9-diethyl ester
  • Azelaic acid, diethyl ester
  • Nonanedioic acid, diethyl ester
  • Diethyl azelaate
  • Diethyl nonanedioate
  • NSC 61074

Work with Diethyl azelate

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

Diethyl sebacate110-40-7100 % similar Diethyl pimelate2050-20-6100 % similar Diethyl suberate2050-23-9100 % similar Diethyl glutarate818-38-290 % similar Ethyl heptanoate106-30-983 % similar Ethyl octanoate106-32-183 % similar Ethyl dodecanoate106-33-283 % similar Ethyl decanoate110-38-383 % similar

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

Same formula

Brassylic acid505-52-2 1,3-Diethyl 2,2-dipropylpropanedioate6065-63-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook