Chemical Properties of 2,6-diphenyl-1,4-hexadiene

InChI

InChI=1S/C18H18/c1-16(18-14-6-3-7-15-18)10-8-9-13-17-11-4-2-5-12-17/h2-9,11-12,14-15H,1,10,13H2/b9-8-

InChI Key

KMTSCEPZNOKULZ-HJWRWDBZSA-N

Formula

C18H18

SMILES

C=C(CC=CCc1ccccc1)c1ccccc1

Molecular Weight¹

234.34

• 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).
• 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°	485.01	kJ/mol	Joback Calculated Property
ΔfH°gas	291.07	kJ/mol	Joback Calculated Property
ΔfusH°	28.07	kJ/mol	Joback Calculated Property
ΔvapH°	59.58	kJ/mol	Joback Calculated Property
log10WS	-5.44		Crippen Calculated Property
logPoct/wat	4.889		Crippen Calculated Property
McVol	208.360	ml/mol	McGowan Calculated Property
Pc	2094.58	kPa	Joback Calculated Property
Inp	[1927.70; 1927.70]
Inp	1927.70		NIST
Inp	1927.70		NIST
Tboil	665.32	K	Joback Calculated Property
Tc	904.69	K	Joback Calculated Property
Tfus	324.66	K	Joback Calculated Property
Vc	0.789	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[532.66; 624.60]	J/mol×K	[665.32; 904.69]
Cp,gas	532.66	J/mol×K	665.32	Joback Calculated Property
Cp,gas	551.15	J/mol×K	705.22	Joback Calculated Property
Cp,gas	568.21	J/mol×K	745.11	Joback Calculated Property
Cp,gas	583.96	J/mol×K	785.01	Joback Calculated Property
Cp,gas	598.53	J/mol×K	824.90	Joback Calculated Property
Cp,gas	612.04	J/mol×K	864.80	Joback Calculated Property
Cp,gas	624.60	J/mol×K	904.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6-diphenyl-1,4-hexadiene.

Sources

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

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