Bis(2-ethoxyethyl) adipate

C14H26O6CAS 109-44-4290.36 g/mol

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EsterEther

Properties

Molecular formula
C14H26O6
Molar mass
290.36 g/mol
Exact mass
290.1729 Da
Density
1.042 g/mL (at 20 °C)
Boiling point
200–220 °C (at 10 Torr)
logP
1.71Crippen estimate
Polar surface area
71.1 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
13

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
109-44-4
SMILES
CCOCCOC(=O)CCCCC(=O)OCCOCC
InChIKey
NJEMMCIKSMMBDM-UHFFFAOYSA-N
InChI
InChI=1S/C14H26O6/c1-3-17-9-11-19-13(15)7-5-6-8-14(16)20-12-10-18-4-2/h3-12H2,1-2H3

Weigh it out

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Names and synonyms

7 names
  • Hexanedioic acid, 1,6-bis(2-ethoxyethyl) ester
  • Adipic acid, bis(2-ethoxyethyl) ester
  • Hexanedioic acid, bis(2-ethoxyethyl) ester
  • Ethanol, 2-ethoxy-, adipate (2:1)
  • Bis(ethoxyethyl) adipate
  • NSC 6796
  • Di(2-ethoxyethyl)adipate

Work with Bis(2-ethoxyethyl) adipate

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1'-(Oxydi-2,1-ethanediyl) dioctadecanoate109-30-867 % similar Bis(2-butoxyethyl) adipate141-18-467 % similar Diethyl adipate141-28-665 % similar Ethyl 3-ethoxypropionate763-69-964 % similar Ethylene brassylate105-95-364 % similar Diethyl sebacate110-40-763 % similar Diethyl pimelate2050-20-663 % similar Diethyl suberate2050-23-963 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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