chempirical

Diethyl glutarate

C9H16O4CAS 818-38-2188.22 g/mol

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Ester

Properties

Molecular formula
C9H16O4
Molar mass
188.22 g/mol
Exact mass
188.1049 Da
Density
1.027 g/mL (at 15 °C)
Melting point
−24.1 °C
Boiling point
236.5 °C
logP
1.28Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Identifiers

CAS number
818-38-2
SMILES
CCOC(=O)CCCC(=O)OCC
InChIKey
OUWSNHWQZPEFEX-UHFFFAOYSA-N
InChI
InChI=1S/C9H16O4/c1-3-12-8(10)6-5-7-9(11)13-4-2/h3-7H2,1-2H3

Weigh it out

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

Names and synonyms

6 names
  • Pentanedioic acid, 1,5-diethyl ester
  • Glutaric acid, diethyl ester
  • Pentanedioic acid, diethyl ester
  • Ethyl glutarate
  • Diethyl pentanedioate
  • NSC 8890

Work with Diethyl glutarate

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 sebacate110-40-790 % similar Diethyl pimelate2050-20-690 % similar Diethyl suberate2050-23-990 % similar Diethyl azelate624-17-990 % similar Ethyl pentanoate539-82-282 % similar Ethyl hexanoate123-66-078 % similar Ethyl heptanoate106-30-975 % similar Ethyl octanoate106-32-175 % similar

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

Same formula

Azelaic acid123-99-9 Diisopropyl malonate13195-64-7 1,3-Diethyl 2-ethylpropanedioate133-13-1 Dipropylmalonic acid1636-27-7 Dimethyl pimelate1732-08-7 Dimethyl diethylmalonate27132-23-6 Ethyl 3,3-diethoxy-2-propenoate32002-24-7 1-(1,1-Dimethylethyl) 3-ethyl propanedioate32864-38-3

Elsewhere

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