Chemical Properties of 13-Heptatricosene

InChI

InChI=1S/C37H74/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h25,27H,3-24,26,28-37H2,1-2H3/b27-25+

InChI Key

ZIWNFSUMWIISLR-IMVLJIQESA-N

Formula

C37H74

SMILES

CCCCCCCCCCCCC=CCCCCCCCCCCCCCCCCCCCCCCC

Molecular Weight¹

518.98

• 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).
• I_np : Non-polar retention indices.
• 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	1.3861		Relay (1.0) Calculated Property
ΔfG°	340.88	kJ/mol	Joback Calculated Property
ΔfH°gas	-740.85	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	91.79	kJ/mol	Joback Calculated Property
ΔvapH°	182.75	kJ/mol	Relay (1.0) Calculated Property
IE	9.68	eV	Relay (1.0) Calculated Property
log10WS	-12.88		Relay (1.0) Calculated Property
logPoct/wat	14.456		Crippen Calculated Property
McVol	527.890	ml/mol	McGowan Calculated Property
Pc	449.25	kPa	Joback Calculated Property
Inp	[3672.00; 3672.00]
Inp	3672.00		NIST
Inp	3672.00		NIST
Tboil	685.59	K	Relay (1.0) Calculated Property
Tc	858.31	K	Relay (1.0) Calculated Property
Tfus	315.41	K	Relay (1.0) Calculated Property
Vc	2.081	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[776.39; 1897.61]	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			-4.49270e+01
Coefficient B			3.53884e+00
Coefficient C			-2.07280e-03
Coefficient D			4.76500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	776.39	J/mol×K	273.00	Calculated Property
Cp,gas	968.71	J/mol×K	353.78	Calculated Property
Cp,gas	1140.57	J/mol×K	434.56	Calculated Property
Cp,gas	1293.50	J/mol×K	515.33	Calculated Property
Cp,gas	1428.98	J/mol×K	596.11	Calculated Property
Cp,gas	1548.54	J/mol×K	676.89	Calculated Property
Cp,gas	1653.68	J/mol×K	757.67	Calculated Property
Cp,gas	1745.90	J/mol×K	838.44	Calculated Property
Cp,gas	1826.71	J/mol×K	919.22	Calculated Property
Cp,gas	1897.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003623; 0.0000107]	Pa×s	[501.67; 944.16]	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			-1.54391e+01
Coefficient B			3.77060e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			501.67
Temperature range, max.			944.16
η	0.0003623	Pa×s	501.67	Calculated Property
η	0.0001852	Pa×s	550.84	Calculated Property
η	0.0001057	Pa×s	600.00	Calculated Property
η	0.0000657	Pa×s	649.17	Calculated Property
η	0.0000436	Pa×s	698.33	Calculated Property
η	0.0000306	Pa×s	747.50	Calculated Property
η	0.0000224	Pa×s	796.67	Calculated Property
η	0.0000170	Pa×s	845.83	Calculated Property
η	0.0000133	Pa×s	895.00	Calculated Property
η	0.0000107	Pa×s	944.16	Calculated Property

Similar Compounds

Find more compounds similar to 13-Heptatricosene.

Sources

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

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