Chemical Properties of Syn-(5,16:8,13)-diethenodibenzo[a,g]cyclododecene 6,7,14,15-tetrahydro-

InChI

InChI=1S/C24H20/c1-2-6-22-18-10-9-17(21(22)5-1)13-14-19-11-12-20(16-15-18)24-8-4-3-7-23(19)24/h1-12H,13-16H2

InChI Key

FETNXYIKSUXFQS-UHFFFAOYSA-N

Formula

C24H20

SMILES

c1ccc2c3ccc(c2c1)CCc1ccc(c2ccccc12)CC3

Molecular Weight¹

308.42

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.6323		Relay (1.0) Calculated Property
ΔfG°	607.16	kJ/mol	Joback Calculated Property
ΔfH°gas	301.43	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.44	kJ/mol	Joback Calculated Property
ΔvapH°	136.10	kJ/mol	Relay (1.0) Calculated Property
IE	[7.25; 7.50]	eV
IE	7.25	eV	NIST
IE	7.50	eV	NIST
log10WS	-8.70		Relay (1.0) Calculated Property
logPoct/wat	5.877		Crippen Calculated Property
McVol	251.720	ml/mol	McGowan Calculated Property
Pc	1989.43	kPa	Joback Calculated Property
Tboil	773.47	K	Relay (1.0) Calculated Property
Tc	1086.65	K	Relay (1.0) Calculated Property
Tfus	532.58	K	Relay (1.0) Calculated Property
Vc	0.937	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[297.71; 801.59]	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			-1.53730e+02
Coefficient B			2.04840e+00
Coefficient C			-1.57868e-03
Coefficient D			4.85600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	297.71	J/mol×K	273.00	Calculated Property
Cp,gas	394.86	J/mol×K	353.78	Calculated Property
Cp,gas	478.15	J/mol×K	434.56	Calculated Property
Cp,gas	549.09	J/mol×K	515.33	Calculated Property
Cp,gas	609.23	J/mol×K	596.11	Calculated Property
Cp,gas	660.09	J/mol×K	676.89	Calculated Property
Cp,gas	703.23	J/mol×K	757.67	Calculated Property
Cp,gas	740.17	J/mol×K	838.44	Calculated Property
Cp,gas	772.44	J/mol×K	919.22	Calculated Property
Cp,gas	801.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014536; 0.0005162]	Pa×s	[547.22; 802.24]	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			-9.79052e+00
Coefficient B			1.78218e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			547.22
Temperature range, max.			802.24
η	0.0014536	Pa×s	547.22	Calculated Property
η	0.0012382	Pa×s	575.56	Calculated Property
η	0.0010708	Pa×s	603.89	Calculated Property
η	0.0009381	Pa×s	632.23	Calculated Property
η	0.0008313	Pa×s	660.56	Calculated Property
η	0.0007440	Pa×s	688.90	Calculated Property
η	0.0006717	Pa×s	717.23	Calculated Property
η	0.0006112	Pa×s	745.57	Calculated Property
η	0.0005599	Pa×s	773.91	Calculated Property
η	0.0005162	Pa×s	802.24	Calculated Property

Similar Compounds

Find more compounds similar to Syn-(5,16:8,13)-diethenodibenzo[a,g]cyclododecene 6,7,14,15-tetrahydro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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