Chemical Properties of (E)-dehydro-apofarnesol

InChI

InChI=1S/C14H26O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,9,14-15H,5-6,8,10-11H2,1-4H3/b13-9+

InChI Key

SVHDKVPXRARVAO-UKTHLTGXSA-N

Formula

C14H26O

SMILES

CC(C)=CCCC(C)=CCCC(C)CO

Molecular Weight¹

210.36

• 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	0.6836		Relay (1.0) Calculated Property
ΔfG°	71.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-359.17	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	30.37	kJ/mol	Joback Calculated Property
ΔvapH°	86.57	kJ/mol	Relay (1.0) Calculated Property
IE	8.21	eV	Relay (1.0) Calculated Property
log10WS	-4.00		Relay (1.0) Calculated Property
logPoct/wat	4.088		Crippen Calculated Property
McVol	205.390	ml/mol	McGowan Calculated Property
Pc	1813.86	kPa	Joback Calculated Property
Inp	[1585.00; 1585.00]
Inp	1585.00		NIST
Inp	1585.00		NIST
Tboil	556.67	K	Relay (1.0) Calculated Property
Tc	726.57	K	Relay (1.0) Calculated Property
Tfus	238.48	K	Relay (1.0) Calculated Property
Vc	0.715	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[542.18; 625.35]	J/mol×K	[619.54; 794.30]
Cp,gas	542.18	J/mol×K	619.54	Joback Calculated Property
Cp,gas	557.74	J/mol×K	648.67	Joback Calculated Property
Cp,gas	572.57	J/mol×K	677.79	Joback Calculated Property
Cp,gas	586.71	J/mol×K	706.92	Joback Calculated Property
Cp,gas	600.19	J/mol×K	736.05	Joback Calculated Property
Cp,gas	613.06	J/mol×K	765.17	Joback Calculated Property
Cp,gas	625.35	J/mol×K	794.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to (E)-dehydro-apofarnesol.

Sources

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

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