Chemical Properties of 2,6,10,14,18-Pentamethyl-13-(3-methyl-pent-4-enylidene)-nonadeca-2,6,10-triene, cis

InChI

InChI=1S/C30H52/c1-10-26(6)20-22-30(29(9)19-12-15-25(4)5)23-21-28(8)18-13-17-27(7)16-11-14-24(2)3/h10,14,17,21-22,25-26,29H,1,11-13,15-16,18-20,23H2,2-9H3/b27-17+,28-21+,30-22+

InChI Key

BNYPZWFLESHHNE-VZKDKEEGSA-N

Formula

C30H52

SMILES

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

Molecular Weight¹

412.73

• 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.
• 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	0.6915		Relay (... Calculated Property
ΔfG°	568.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-356.72	kJ/mol	Relay (... Calculated Property
ΔfusH°	57.17	kJ/mol	Joback Calculated Property
ΔvapH°	107.51	kJ/mol	Relay (... Calculated Property
IE	7.81	eV	Relay (... Calculated Property
log10WS	-9.18		Relay (... Calculated Property
logPoct/wat	10.397		Crippen Calculated Property
McVol	412.060	ml/mol	McGowan Calculated Property
Pc	691.07	kPa	Joback Calculated Property
Inp	[2505.00; 2519.00]
Inp	2505.00		NIST
Inp	2519.00		NIST
Inp	2505.00		NIST
Tboil	661.08	K	Relay (... Calculated Property
Tc	803.57	K	Relay (... Calculated Property
Tfus	239.71	K	Relay (... Calculated Property
Vc	1.413	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1347.52; 1477.64]	J/mol×K	[897.32; 1099.61]
Cp,gas	1347.52	J/mol×K	897.32	Joback Calculated Property
Cp,gas	1371.19	J/mol×K	931.04	Joback Calculated Property
Cp,gas	1393.90	J/mol×K	964.75	Joback Calculated Property
Cp,gas	1415.77	J/mol×K	998.47	Joback Calculated Property
Cp,gas	1436.93	J/mol×K	1032.18	Joback Calculated Property
Cp,gas	1457.51	J/mol×K	1065.90	Joback Calculated Property
Cp,gas	1477.64	J/mol×K	1099.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6,10,14,18-Pentamethyl-13-(3-methyl-pent-4-enylidene)-nonadeca-2,6,10-triene, cis.

Sources

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

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