chempirical

Diethyl succinate

C8H14O4CAS 123-25-1174.20 g/mol

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Ester

Properties

Molecular formula
C8H14O4
Molar mass
174.20 g/mol
Exact mass
174.0892 Da
Density
1.041 g/mL (at 20 °C)
Melting point
−21 °C
Boiling point
217.7 °C
logP
0.89Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
5

Identifiers

CAS number
123-25-1
SMILES
CCOC(=O)CCC(=O)OCC
InChIKey
DKMROQRQHGEIOW-UHFFFAOYSA-N
InChI
InChI=1S/C8H14O4/c1-3-11-7(9)5-6-8(10)12-4-2/h3-6H2,1-2H3

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Names and synonyms

11 names
  • Butanedioic acid, 1,4-diethyl ester
  • Succinic acid, diethyl ester
  • Butanedioic acid, diethyl ester
  • Ethyl succinate
  • Clorius
  • Diethyl butanedioate
  • NSC 8875
  • Butandioic acid diethyl ester
  • DESU
  • 1,4-Diethyl butanedioate
  • Diethyl 1,2-ethanedicarboxylate

Reactions

Work with Diethyl succinate

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 glutarate818-38-284 % similar Ethyl butyrate105-54-476 % similar Diethyl sebacate110-40-776 % similar Diethyl pimelate2050-20-676 % similar Diethyl suberate2050-23-976 % similar Diethyl azelate624-17-976 % similar Ethyl levulinate539-88-874 % similar Monoethyl succinate1070-34-471 % similar

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

Same formula

2,3-Diacetoxybutane1114-92-7 1,3-Butylene glycol diacetate1117-31-3 (E)-Ethyl 4,4-dimethoxybut-2-enoate114736-25-3 1,4-Bis(2-hydroxyethoxy)-2-butyne1606-85-5 Glycol diglycidyl ether2224-15-9 1-(1,1-Dimethylethyl) 3-methyl propanedioate42726-73-8 Suberic acid505-48-6 Dimethyl isosorbide5306-85-4

Elsewhere

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