Chemical Properties of trans--4-Nonene (CAS 10405-85-3)

InChI

InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h7,9H,3-6,8H2,1-2H3/b9-7-

InChI Key

KPADFPAILITQBG-CLFYSBASSA-N

Formula

C9H18

SMILES

CCCC=CCCCC

Molecular Weight¹

126.24

CAS

10405-85-3

Other Names

• (E)-4-C9H18
• 4-Nonene, (E)-
• (4E)-4-Nonene
• (E)-4-Nonene
• 4-Nonene, (Z)-
• (4Z)-4-Nonene
• (Z)-4-C9H18

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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.
• I_p : 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	0.3576		Relay (1.0) Calculated Property
ΔfG°	105.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-150.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.27	kJ/mol	Joback Calculated Property
ΔvapH°	46.60	kJ/mol	Relay (1.0) Calculated Property
IE	[8.80; 8.81]	eV
IE	8.81 ± 0.01	eV	NIST
IE	8.80 ± 0.01	eV	NIST
log10WS	-4.79		Relay (1.0) Calculated Property
logPoct/wat	3.533		Crippen Calculated Property
McVol	133.370	ml/mol	McGowan Calculated Property
Pc	2426.65	kPa	Joback Calculated Property
Inp	[839.00; 897.00]
Inp	884.00		NIST
Inp	894.00		NIST
Inp	894.00		NIST
Inp	894.00		NIST
Inp	894.00		NIST
Inp	876.00		NIST
Inp	876.00		NIST
Inp	884.00		NIST
Inp	884.00		NIST
Inp	884.00		NIST
Inp	887.20		NIST
Inp	887.80		NIST
Inp	884.10		NIST
Inp	884.00		NIST
Inp	884.40		NIST
Inp	884.20		NIST
Inp	893.00		NIST
Inp	894.00		NIST
Inp	894.00		NIST
Inp	893.00		NIST
Inp	884.00		NIST
Inp	Outlier 839.00		NIST
Inp	Outlier 840.00		NIST
Inp	885.00		NIST
Inp	895.00		NIST
Inp	896.00		NIST
Inp	897.00		NIST
Inp	885.00		NIST
Inp	886.00		NIST
Inp	890.70		NIST
Inp	892.40		NIST
Inp	885.10		NIST
Inp	885.00		NIST
Inp	886.00		NIST
Inp	884.80		NIST
Inp	895.00		NIST
Inp	885.00		NIST
Ip	[937.00; 973.00]
Ip	941.00		NIST
Ip	941.00		NIST
Ip	939.00		NIST
Ip	941.00		NIST
Ip	937.00		NIST
Ip	940.70		NIST
Ip	939.20		NIST
Ip	941.20		NIST
Ip	939.20		NIST
Ip	940.70		NIST
Ip	941.20		NIST
Ip	Outlier 973.00		NIST
Ip	952.00		NIST
Ip	953.00		NIST
Ip	948.00		NIST
Ip	947.00		NIST
Ip	952.00		NIST
Ip	948.50		NIST
Ip	951.80		NIST
Ip	948.50		NIST
Ip	952.00		NIST
Ip	951.80		NIST
Ip	952.00		NIST
Ip	951.80		NIST
Tboil	417.50	K	Relay (1.0) Calculated Property
Tc	591.82	K	Relay (1.0) Calculated Property
Tfus	177.36	K	Relay (1.0) Calculated Property
Vc	0.524	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔvapH	[40.10; 40.40]	kJ/mol	[398.00; 398.50]
ΔvapH	40.40	kJ/mol	398.00	NIST
ΔvapH	40.10	kJ/mol	398.50	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[182.40; 453.06]	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			-1.94750e+01
Coefficient B			8.78840e-01
Coefficient C			-5.49600e-04
Coefficient D			1.43300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	182.40	J/mol×K	273.00	Calculated Property
Cp,gas	229.00	J/mol×K	353.78	Calculated Property
Cp,gas	270.40	J/mol×K	434.56	Calculated Property
Cp,gas	307.08	J/mol×K	515.33	Calculated Property
Cp,gas	339.47	J/mol×K	596.11	Calculated Property
Cp,gas	368.03	J/mol×K	676.89	Calculated Property
Cp,gas	393.22	J/mol×K	757.67	Calculated Property
Cp,gas	415.48	J/mol×K	838.44	Calculated Property
Cp,gas	435.28	J/mol×K	919.22	Calculated Property
Cp,gas	453.06	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0055889; 0.0002052]	Pa×s	[186.11; 406.63]	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			-1.12808e+01
Coefficient B			1.13412e+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.			186.11
Temperature range, max.			406.63
η	0.0055889	Pa×s	186.11	Calculated Property
η	0.0027506	Pa×s	210.61	Calculated Property
η	0.0015693	Pa×s	235.11	Calculated Property
η	0.0009954	Pa×s	259.62	Calculated Property
η	0.0006830	Pa×s	284.12	Calculated Property
η	0.0004975	Pa×s	308.62	Calculated Property
η	0.0003796	Pa×s	333.12	Calculated Property
η	0.0003007	Pa×s	357.63	Calculated Property
η	0.0002453	Pa×s	382.13	Calculated Property
η	0.0002052	Pa×s	406.63	Calculated Property

Similar Compounds

Find more compounds similar to trans--4-Nonene.

Sources

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

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