Chemical Properties of 2-Tridecyne (CAS 28467-75-6)

InChI

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

InChI Key

ZGKKGWBQPYIOBH-UHFFFAOYSA-N

Formula

C13H24

SMILES

CC#CCCCCCCCCCC

Molecular Weight¹

180.33

CAS

28467-75-6

Other Names

• 2-C13H24

• 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	9.28 ± 0.02	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	[1341.00; 1364.00]
Inp	1341.00		NIST
Inp	1364.00		NIST
Inp	1351.00		NIST
Inp	1351.00		NIST
Inp	1351.00		NIST
I	[1526.90; 1568.00]
I	1562.00		NIST
I	1563.00		NIST
I	1565.00		NIST
I	1565.00		NIST
I	1568.00		NIST
I	1526.90		NIST
I	1549.90		NIST
I	1531.50		NIST
I	1552.90		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	[394.52; 532.20]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.65985e+01
Coefficient B			-5.04535e+03
Coefficient C			-8.51960e+01
Temperature range, min.			394.52
Temperature range, max.			532.20
Pvap	1.33	kPa	394.52	Calculated Property
Pvap	2.88	kPa	409.82	Calculated Property
Pvap	5.79	kPa	425.12	Calculated Property
Pvap	10.97	kPa	440.41	Calculated Property
Pvap	19.71	kPa	455.71	Calculated Property
Pvap	33.83	kPa	471.01	Calculated Property
Pvap	55.70	kPa	486.31	Calculated Property
Pvap	88.42	kPa	501.60	Calculated Property
Pvap	135.84	kPa	516.90	Calculated Property
Pvap	202.64	kPa	532.20	Calculated Property

Similar Compounds

Find more compounds similar to 2-Tridecyne.

Sources

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

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