Chemical Properties of (4E)-3,6,9,10,13,14-hexamethyl-3-(3,4,7,8-tetramethylnonyl)-1,4-pentadecadiene

InChI

InChI=1S/C33H64/c1-13-26(5)15-17-30(9)32(11)22-24-33(12,14-2)23-21-27(6)16-18-29(8)31(10)20-19-28(7)25(3)4/h14,21,23,25-32H,2,13,15-20,22,24H2,1,3-12H3/b23-21+

InChI Key

NBOHZPQWJWZHLT-XTQSDGFTSA-N

Formula

C33H64

SMILES

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

Molecular Weight¹

460.86

• 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).
• 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
ΔfG°	378.36	kJ/mol	Joback Calculated Property
ΔfH°gas	-532.79	kJ/mol	Joback Calculated Property
ΔfusH°	44.55	kJ/mol	Joback Calculated Property
ΔvapH°	83.94	kJ/mol	Joback Calculated Property
log10WS	-11.17		Crippen Calculated Property
logPoct/wat	11.374		Crippen Calculated Property
McVol	467.230	ml/mol	McGowan Calculated Property
Pc	564.47	kPa	Joback Calculated Property
Inp	[2761.00; 2761.00]
Inp	2761.00		NIST
Inp	2761.00		NIST
Tboil	948.53	K	Joback Calculated Property
Tc	1162.60	K	Joback Calculated Property
Tfus	337.25	K	Joback Calculated Property
Vc	1.786	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1630.81; 1771.04]	J/mol×K	[948.53; 1162.60]
Cp,gas	1630.81	J/mol×K	948.53	Joback Calculated Property
Cp,gas	1657.26	J/mol×K	984.21	Joback Calculated Property
Cp,gas	1682.29	J/mol×K	1019.89	Joback Calculated Property
Cp,gas	1706.05	J/mol×K	1055.56	Joback Calculated Property
Cp,gas	1728.66	J/mol×K	1091.24	Joback Calculated Property
Cp,gas	1750.28	J/mol×K	1126.92	Joback Calculated Property
Cp,gas	1771.04	J/mol×K	1162.60	Joback Calculated Property
η	[0.0000053; 0.0086511]	Pa×s	[337.25; 948.53]
η	0.0086511	Pa×s	337.25	Joback Calculated Property
η	0.0006030	Pa×s	439.13	Joback Calculated Property
η	0.0001146	Pa×s	541.01	Joback Calculated Property
η	0.0000369	Pa×s	642.89	Joback Calculated Property
η	0.0000162	Pa×s	744.77	Joback Calculated Property
η	0.0000087	Pa×s	846.65	Joback Calculated Property
η	0.0000053	Pa×s	948.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to (4E)-3,6,9,10,13,14-hexamethyl-3-(3,4,7,8-tetramethylnonyl)-1,4-pentadecadiene.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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