Chemical Properties of 6-Tridecyne (CAS 42371-66-4)

InChI

InChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-11H2,1-2H3

InChI Key

DFZSEVCTTZHGAS-UHFFFAOYSA-N

Formula

C13H24

SMILES

CCCCCC#CCCCCCC

Molecular Weight¹

180.33

CAS

42371-66-4

Other Names

• 6-C13H24
• 6-Tridecane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I : 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
ΔfG°	261.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-39.35	kJ/mol	Joback Calculated Property
ΔfusH°	32.55	kJ/mol	Joback Calculated Property
ΔvapH°	46.68	kJ/mol	Joback Calculated Property
IE	9.05 ± 0.03	eV	NIST
log10WS	-5.06		Crippen Calculated Property
logPoct/wat	4.540		Crippen Calculated Property
McVol	185.430	ml/mol	McGowan Calculated Property
Pc	1880.53	kPa	Joback Calculated Property
Inp	[1296.00; 1320.00]
Inp	1296.00		NIST
Inp	1320.00		NIST
Inp	1303.00		NIST
Inp	1304.00		NIST
Inp	1304.00		NIST
I	[1449.10; 1480.00]
I	1477.00		NIST
I	1478.00		NIST
I	1479.00		NIST
I	1479.00		NIST
I	1480.00		NIST
I	1449.10		NIST
I	1466.50		NIST
I	1452.60		NIST
I	1469.40		NIST
I	1477.00		NIST
I	1449.10		NIST
Tboil	505.84	K	Joback Calculated Property
Tc	685.15	K	Joback Calculated Property
Tfus	342.37	K	Joback Calculated Property
Vc	0.726	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[424.07; 516.62]	J/mol×K	[505.84; 685.15]
Cp,gas	424.07	J/mol×K	505.84	Joback Calculated Property
Cp,gas	441.19	J/mol×K	535.72	Joback Calculated Property
Cp,gas	457.61	J/mol×K	565.61	Joback Calculated Property
Cp,gas	473.34	J/mol×K	595.49	Joback Calculated Property
Cp,gas	488.41	J/mol×K	625.38	Joback Calculated Property
Cp,gas	502.83	J/mol×K	655.26	Joback Calculated Property
Cp,gas	516.62	J/mol×K	685.15	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[375.95; 535.65]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.77276e+01
Coefficient B			-6.88343e+03
Coefficient C			1.87420e+01
Temperature range, min.			375.95
Temperature range, max.			535.65
Pvap	1.33	kPa	375.95	Calculated Property
Pvap	2.82	kPa	393.69	Calculated Property
Pvap	5.62	kPa	411.44	Calculated Property
Pvap	10.59	kPa	429.18	Calculated Property
Pvap	19.03	kPa	446.93	Calculated Property
Pvap	32.73	kPa	464.67	Calculated Property
Pvap	54.19	kPa	482.42	Calculated Property
Pvap	86.68	kPa	500.16	Calculated Property
Pvap	134.41	kPa	517.91	Calculated Property
Pvap	202.64	kPa	535.65	Calculated Property

Similar Compounds

Find more compounds similar to 6-Tridecyne.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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