chempirical

Dibenzo-24-crown-8

C24H32O8CAS 14174-09-5448.51 g/mol

Open in Covalent MOL file
OOOOOOOO
Ether

Properties

Molecular formula
C24H32O8
Molar mass
448.51 g/mol
Exact mass
448.2097 Da
Melting point
103–105 °C
logP
2.98Crippen estimate
Polar surface area
73.8 Ų
H-bond donors / acceptors
0 / 8
Rotatable bonds
0

Identifiers

CAS number
14174-09-5
SMILES
c1ccc2c(c1)OCCOCCOCCOc1ccccc1OCCOCCOCCO2
InChIKey
UNTITLLXXOKDTB-UHFFFAOYSA-N
InChI
InChI=1S/C24H32O8/c1-2-6-22-21(5-1)29-17-13-25-9-10-27-15-19-31-23-7-3-4-8-24(23)32-20-16-28-12-11-26-14-18-30-22/h1-8H,9-20H2

Weigh it out

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

Names and synonyms

5 names
  • Dibenz[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin, 6,7,9,10,12,13,20,21,23,24,26,27-dodecahydro-
  • 6,7,9,10,12,13,20,21,23,24,26,27-Dodecahydrodibenz[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin
  • Dibenzo24C8
  • NSC 244972
  • Dibenzo-24-crown-8 ether

Work with Dibenzo-24-crown-8

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

Benzo-18-crown-614098-24-9100 % similar Benzo-15-crown-514098-44-3100 % similar Dibenzo-18-crown-614187-32-7100 % similar Benzodioxan493-09-482 % similar 1,3-Benzodioxole274-09-955 % similar 1,2-Diethoxybenzene2050-46-655 % similar 2,2′-[1,2-Ethanediylbis(oxy)]bis[benzenamine]52411-34-454 % similar Dihydrobenzofuran496-16-250 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook