Chemical Properties of 5-Ethyldecane (CAS 17302-36-2)

InChI

InChI=1S/C12H26/c1-4-7-9-11-12(6-3)10-8-5-2/h12H,4-11H2,1-3H3

InChI Key

BCQLAHKMMOGIIS-UHFFFAOYSA-N

Formula

C12H26

SMILES

CCCCCC(CC)CCCC

Molecular Weight¹

170.33

CAS

17302-36-2

Other Names

• Decane, 5-ethyl

• 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).
• P_vap : Vapor 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	0.5199		Relay (1.0) Calculated Property
ΔfG°	47.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-289.06	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.31	kJ/mol	Joback Calculated Property
ΔvapH°	57.66	kJ/mol	Relay (1.0) Calculated Property
IE	9.44	eV	Relay (1.0) Calculated Property
log10WS	-6.27		Relay (1.0) Calculated Property
logPoct/wat	4.783		Crippen Calculated Property
McVol	179.940	ml/mol	McGowan Calculated Property
Pc	1792.42	kPa	Joback Calculated Property
Inp	[1123.00; 1155.00]
Inp	1155.00		NIST
Inp	1123.00		NIST
Inp	1146.00		NIST
Inp	1155.00		NIST
Tboil	476.53	K	Relay (1.0) Calculated Property
Tc	647.80	K	Relay (1.0) Calculated Property
Tfus	190.26	K	Relay (1.0) Calculated Property
Vc	0.678	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[259.73; 638.96]	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			-9.70200e+00
Coefficient B			1.14976e+00
Coefficient C			-6.32200e-04
Coefficient D			1.31100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	259.73	J/mol×K	273.00	Calculated Property
Cp,gas	323.74	J/mol×K	353.78	Calculated Property
Cp,gas	381.31	J/mol×K	434.56	Calculated Property
Cp,gas	432.86	J/mol×K	515.33	Calculated Property
Cp,gas	478.80	J/mol×K	596.11	Calculated Property
Cp,gas	519.56	J/mol×K	676.89	Calculated Property
Cp,gas	555.53	J/mol×K	757.67	Calculated Property
Cp,gas	587.15	J/mol×K	838.44	Calculated Property
Cp,gas	614.82	J/mol×K	919.22	Calculated Property
Cp,gas	638.96	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0101808; 0.0002445]	Pa×s	[210.00; 446.61]	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			-1.16262e+01
Coefficient B			1.47818e+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.			210.00
Temperature range, max.			446.61
η	0.0101808	Pa×s	210.00	Calculated Property
η	0.0046522	Pa×s	236.29	Calculated Property
η	0.0024868	Pa×s	262.58	Calculated Property
η	0.0014899	Pa×s	288.87	Calculated Property
η	0.0009722	Pa×s	315.16	Calculated Property
η	0.0006775	Pa×s	341.45	Calculated Property
η	0.0004972	Pa×s	367.74	Calculated Property
η	0.0003802	Pa×s	394.03	Calculated Property
η	0.0003007	Pa×s	420.32	Calculated Property
η	0.0002445	Pa×s	446.61	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[355.52; 505.14]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.41833e+01
Coefficient B			-3.67139e+03
Coefficient C			-9.13150e+01
Temperature range, min.			355.52
Temperature range, max.			505.14
Pvap	1.33	kPa	355.52	Calculated Property
Pvap	3.03	kPa	372.14	Calculated Property
Pvap	6.30	kPa	388.77	Calculated Property
Pvap	12.11	kPa	405.39	Calculated Property
Pvap	21.79	kPa	422.02	Calculated Property
Pvap	37.07	kPa	438.64	Calculated Property
Pvap	60.09	kPa	455.27	Calculated Property
Pvap	93.36	kPa	471.89	Calculated Property
Pvap	139.80	kPa	488.52	Calculated Property
Pvap	202.65	kPa	505.14	Calculated Property

Similar Compounds

Find more compounds similar to 5-Ethyldecane.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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