Chemical Properties of Linolene aldehyde

InChI

InChI=1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h3-4,6-7,9-10,18H,2,5,8,11-17H2,1H3/b4-3-,7-6-,10-9-

InChI Key

TUCMDDWTBVMRTP-PDBXOOCHSA-N

Formula

C18H30O

SMILES

CCC=CCC=CCC=CCCCCCCCC=O

Molecular Weight¹

262.43

• 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	0.6248		Relay (1.0) Calculated Property
ΔfG°	241.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-326.82	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	45.27	kJ/mol	Joback Calculated Property
ΔvapH°	96.19	kJ/mol	Relay (1.0) Calculated Property
IE	8.55	eV	Relay (1.0) Calculated Property
log10WS	-5.73		Relay (1.0) Calculated Property
logPoct/wat	5.775		Crippen Calculated Property
McVol	253.150	ml/mol	McGowan Calculated Property
Pc	1355.63	kPa	Joback Calculated Property
Inp	[1969.00; 1969.00]
Inp	1969.00		NIST
Inp	1969.00		NIST
Tboil	582.72	K	Relay (1.0) Calculated Property
Tc	772.99	K	Relay (1.0) Calculated Property
Tfus	284.19	K	Relay (1.0) Calculated Property
Vc	0.886	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.23; 847.00]	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			-4.46200e+01
Coefficient B			1.74832e+00
Coefficient C			-1.19980e-03
Coefficient D			3.43100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	350.23	J/mol×K	273.00	Calculated Property
Cp,gas	438.92	J/mol×K	353.78	Calculated Property
Cp,gas	516.71	J/mol×K	434.56	Calculated Property
Cp,gas	584.67	J/mol×K	515.33	Calculated Property
Cp,gas	643.90	J/mol×K	596.11	Calculated Property
Cp,gas	695.48	J/mol×K	676.89	Calculated Property
Cp,gas	740.50	J/mol×K	757.67	Calculated Property
Cp,gas	780.03	J/mol×K	838.44	Calculated Property
Cp,gas	815.17	J/mol×K	919.22	Calculated Property
Cp,gas	847.00	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0028878; 0.0001313]	Pa×s	[319.38; 596.05]	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			-1.25060e+01
Coefficient B			2.12667e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			319.38
Temperature range, max.			596.05
η	0.0028878	Pa×s	319.38	Calculated Property
η	0.0016094	Pa×s	350.12	Calculated Property
η	0.0009857	Pa×s	380.86	Calculated Property
η	0.0006496	Pa×s	411.60	Calculated Property
η	0.0004536	Pa×s	442.34	Calculated Property
η	0.0003319	Pa×s	473.09	Calculated Property
η	0.0002523	Pa×s	503.83	Calculated Property
η	0.0001979	Pa×s	534.57	Calculated Property
η	0.0001594	Pa×s	565.31	Calculated Property
η	0.0001313	Pa×s	596.05	Calculated Property

Similar Compounds

Find more compounds similar to Linolene aldehyde.

Sources

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

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