Chemical Properties of Isoaromadendrene

InChI

InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3

InChI Key

IHQUEBHATOOKPN-UHFFFAOYSA-N

Formula

C14H22

SMILES

CC1CCC2C=CCC3C(C12)C3(C)C

Molecular Weight¹

190.32

• 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°	226.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-114.21	kJ/mol	Joback Calculated Property
ΔfusH°	20.36	kJ/mol	Joback Calculated Property
ΔvapH°	45.05	kJ/mol	Joback Calculated Property
log10WS	-3.77		Crippen Calculated Property
logPoct/wat	3.881		Crippen Calculated Property
McVol	171.240	ml/mol	McGowan Calculated Property
Pc	2183.60	kPa	Joback Calculated Property
Inp	[1437.00; 1444.00]
Inp	1437.00		NIST
Inp	1444.00		NIST
Tboil	533.87	K	Joback Calculated Property
Tc	753.17	K	Joback Calculated Property
Tfus	306.26	K	Joback Calculated Property
Vc	0.655	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[451.90; 573.56]	J/mol×K	[533.87; 753.17]
Cp,gas	451.90	J/mol×K	533.87	Joback Calculated Property
Cp,gas	475.68	J/mol×K	570.42	Joback Calculated Property
Cp,gas	497.82	J/mol×K	606.97	Joback Calculated Property
Cp,gas	518.50	J/mol×K	643.52	Joback Calculated Property
Cp,gas	537.89	J/mol×K	680.07	Joback Calculated Property
Cp,gas	556.19	J/mol×K	716.62	Joback Calculated Property
Cp,gas	573.56	J/mol×K	753.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Isoaromadendrene.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.