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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[525.44; 1429.95]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-6.25300e+01
Coefficient B			2.31360e+00
Coefficient C			-4.97120e-04
Coefficient D			-3.24000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	525.44	J/mol×K	273.00	Calculated Property
Cp,gas	679.41	J/mol×K	353.78	Calculated Property
Cp,gas	822.39	J/mol×K	434.56	Calculated Property
Cp,gas	953.38	J/mol×K	515.33	Calculated Property
Cp,gas	1071.35	J/mol×K	596.11	Calculated Property
Cp,gas	1175.27	J/mol×K	676.89	Calculated Property
Cp,gas	1264.11	J/mol×K	757.67	Calculated Property
Cp,gas	1336.85	J/mol×K	838.44	Calculated Property
Cp,gas	1392.48	J/mol×K	919.22	Calculated Property
Cp,gas	1429.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0416601; 1.4335454e-09]	Pa×s	[377.60; 1113.35]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-2.91827e+01
Coefficient B			9.81930e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			377.60
Temperature range, max.			1113.35
η	0.0416601	Pa×s	377.60	Calculated Property
η	0.0004072	Pa×s	459.35	Calculated Property
η	0.0000161	Pa×s	541.10	Calculated Property
η	0.0000015	Pa×s	622.85	Calculated Property
η	0.0000002	Pa×s	704.60	Calculated Property
η	5.6133892e-08	Pa×s	786.35	Calculated Property
η	1.7319042e-08	Pa×s	868.10	Calculated Property
η	6.5423057e-09	Pa×s	949.85	Calculated Property
η	2.8836794e-09	Pa×s	1031.60	Calculated Property
η	1.4335454e-09	Pa×s	1113.35	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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