Chemical Properties of Isoaromadendrene epoxide

InChI

InChI=1S/C15H24O/c1-8-5-6-9-12(8)13-10(14(13,2)3)7-11-15(9,4)16-11/h8-13H,5-7H2,1-4H3

InChI Key

GLKQAHXBJLGAFT-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC1CCC2C1C1C(CC3OC32C)C1(C)C

Molecular Weight¹

220.35

• 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.
• I : 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°	190.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-244.61	kJ/mol	Joback Calculated Property
ΔfusH°	26.81	kJ/mol	Joback Calculated Property
ΔvapH°	49.61	kJ/mol	Joback Calculated Property
log10WS	-3.54		Crippen Calculated Property
logPoct/wat	3.482		Crippen Calculated Property
McVol	184.640	ml/mol	McGowan Calculated Property
Pc	2086.93	kPa	Joback Calculated Property
Inp	[1579.00; 1612.00]
Inp	1594.00		NIST
Inp	1612.00		NIST
Inp	1612.00		NIST
Inp	1584.00		NIST
Inp	1612.00		NIST
Inp	1579.00		NIST
Inp	1579.00		NIST
Inp	1590.00		NIST
Inp	1590.00		NIST
I	[1807.00; 1807.00]
I	1807.00		NIST
I	1807.00		NIST
Tboil	578.31	K	Joback Calculated Property
Tc	798.81	K	Joback Calculated Property
Tfus	387.98	K	Joback Calculated Property
Vc	0.717	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[543.31; 664.85]	J/mol×K	[578.31; 798.81]
Cp,gas	543.31	J/mol×K	578.31	Joback Calculated Property
Cp,gas	566.49	J/mol×K	615.06	Joback Calculated Property
Cp,gas	588.09	J/mol×K	651.81	Joback Calculated Property
Cp,gas	608.41	J/mol×K	688.56	Joback Calculated Property
Cp,gas	627.78	J/mol×K	725.31	Joback Calculated Property
Cp,gas	646.49	J/mol×K	762.06	Joback Calculated Property
Cp,gas	664.85	J/mol×K	798.81	Joback Calculated Property

Similar Compounds

Find more compounds similar to Isoaromadendrene epoxide.

Sources

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

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