Chemical Properties of dibenzo-30-crown-10

InChI

InChI=1S/C28H40O10/c1-2-6-26-25(5-1)35-21-17-31-13-9-29-11-15-33-19-23-37-27-7-3-4-8-28(27)38-24-20-34-16-12-30-10-14-32-18-22-36-26/h1-8H,9-24H2

InChI Key

MXCSCGGRLMRZMF-UHFFFAOYSA-N

Formula

C28H40O10

SMILES

c1ccc2c(c1)OCCOCCOCCOCCOc1ccccc1OCCOCCOCCOCCO2

Molecular Weight¹

536.62

Other Names

• 6,7,9,10,12,13,15,16,23,24,26,27,29,30,32,33-hexadecahydrodibenzo[b,q][1,4,7,10,13,16,19,22,25,28]decaoxacyclotriacontine

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1056.09; 1403.43]	J/mol×K	[1282.68; 1590.50]
Cp,gas	1403.43	J/mol×K	1282.68	Joback Calculated Property
Cp,gas	1370.02	J/mol×K	1333.98	Joback Calculated Property
Cp,gas	1327.17	J/mol×K	1385.29	Joback Calculated Property
Cp,gas	1274.61	J/mol×K	1436.59	Joback Calculated Property
Cp,gas	1212.09	J/mol×K	1487.89	Joback Calculated Property
Cp,gas	1139.33	J/mol×K	1539.20	Joback Calculated Property
Cp,gas	1056.09	J/mol×K	1590.50	Joback Calculated Property
η	[4.4746908e-10; 0.0000003]	Pa×s	[690.12; 1282.68]
η	0.0000003	Pa×s	690.12	Joback Calculated Property
η	5.3930305e-08	Pa×s	788.88	Joback Calculated Property
η	1.3501588e-08	Pa×s	887.64	Joback Calculated Property
η	4.4603892e-09	Pa×s	986.40	Joback Calculated Property
η	1.8026612e-09	Pa×s	1085.16	Joback Calculated Property
η	8.4741937e-10	Pa×s	1183.92	Joback Calculated Property
η	4.4746908e-10	Pa×s	1282.68	Joback Calculated Property

Similar Compounds

Find more compounds similar to dibenzo-30-crown-10.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Enthalpies of fusion, vaporisation and sublimation of crown ethers determined by thermogravimetry and differential scanning calorimetry
• Joback Method
• McGowan Method

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