Chemical Properties of 2,6,10,14-Tetramethyl-9-(3-methyl-pent-4-enyl)-pentadeca-2,6,10-triene

InChI

InChI=1S/C25H44/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h9,12,15,17,21-22,25H,1,10-11,13-14,16,18-19H2,2-8H3/b23-17+,24-15+

InChI Key

MKKVQZKPCITHAF-BXPHKCKFSA-N

Formula

C25H44

SMILES

C=CC(C)CCC(CC=C(C)CCC=C(C)C)C(C)=CCCC(C)C

Molecular Weight¹

344.62

Other Names

• Pentadeca-5,9,13-triene, 2,6,10,14-tetramethyl-7-(3-methylpent-4-enyl)

• ω : Acentric Factor.
• 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).
• 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
ω	0.6157		Relay (... Calculated Property
ΔfG°	455.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-307.43	kJ/mol	Relay (... Calculated Property
ΔfusH°	45.33	kJ/mol	Joback Calculated Property
ΔvapH°	92.25	kJ/mol	Relay (... Calculated Property
IE	7.96	eV	Relay (... Calculated Property
log10WS	-8.08		Relay (... Calculated Property
logPoct/wat	8.670		Crippen Calculated Property
McVol	345.910	ml/mol	McGowan Calculated Property
Pc	874.80	kPa	Joback Calculated Property
Inp	[2134.00; 2152.00]
Inp	2134.00		NIST
Inp	2138.00		NIST
Inp	2143.00		NIST
Inp	2146.00		NIST
Inp	2152.00		NIST
Inp	2146.00		NIST
Inp	2134.00		NIST
I	[2221.00; 2227.00]
I	2221.00		NIST
I	2227.00		NIST
I	2221.00		NIST
Tboil	627.81	K	Relay (... Calculated Property
Tc	765.77	K	Relay (... Calculated Property
Tfus	227.51	K	Relay (... Calculated Property
Vc	1.192	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1053.63; 1171.47]	J/mol×K	[778.88; 966.44]
Cp,gas	1053.63	J/mol×K	778.88	Joback Calculated Property
Cp,gas	1075.61	J/mol×K	810.14	Joback Calculated Property
Cp,gas	1096.54	J/mol×K	841.40	Joback Calculated Property
Cp,gas	1116.50	J/mol×K	872.66	Joback Calculated Property
Cp,gas	1135.60	J/mol×K	903.92	Joback Calculated Property
Cp,gas	1153.89	J/mol×K	935.18	Joback Calculated Property
Cp,gas	1171.47	J/mol×K	966.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6,10,14-Tetramethyl-9-(3-methyl-pent-4-enyl)-pentadeca-2,6,10-triene.

Sources

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

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