Chemical Properties of (E)-2-Hexyl-cinnamaldehyde

InChI

InChI=1S/C15H20O/c1-2-3-4-6-11-15(13-16)12-14-9-7-5-8-10-14/h5,7-10,12-13H,2-4,6,11H2,1H3/b15-12+

InChI Key

GUUHFMWKWLOQMM-NTCAYCPXSA-N

Formula

C15H20O

SMILES

CCCCCCC(C=O)=Cc1ccccc1

Molecular Weight¹

216.32

Other Names

• 2-Hexyl-(E)-cinnamaldehyde

• 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°	159.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-94.55	kJ/mol	Joback Calculated Property
ΔfusH°	29.83	kJ/mol	Joback Calculated Property
ΔvapH°	58.02	kJ/mol	Joback Calculated Property
log10WS	-4.51		Crippen Calculated Property
logPoct/wat	4.239		Crippen Calculated Property
McVol	195.720	ml/mol	McGowan Calculated Property
Pc	2073.65	kPa	Joback Calculated Property
Inp	[1749.00; 1754.00]
Inp	1754.00		NIST
Inp	1749.00		NIST
Tboil	621.98	K	Joback Calculated Property
Tc	827.96	K	Joback Calculated Property
Tfus	308.19	K	Joback Calculated Property
Vc	0.765	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[497.60; 583.40]	J/mol×K	[621.98; 827.96]
Cp,gas	497.60	J/mol×K	621.98	Joback Calculated Property
Cp,gas	514.24	J/mol×K	656.31	Joback Calculated Property
Cp,gas	529.87	J/mol×K	690.64	Joback Calculated Property
Cp,gas	544.54	J/mol×K	724.97	Joback Calculated Property
Cp,gas	558.31	J/mol×K	759.30	Joback Calculated Property
Cp,gas	571.25	J/mol×K	793.63	Joback Calculated Property
Cp,gas	583.40	J/mol×K	827.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to (E)-2-Hexyl-cinnamaldehyde.

Sources

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

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