Chemical Properties of «beta»-Guajene

InChI

InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11,13-15H,1,4-9H2,2-3H3/t11-,13+,14?,15?/m1/s1

InChI Key

LCJVFGFKVDTMSS-WSYDAFBYSA-N

Formula

C15H24

SMILES

C=C(C)C1CCC(C)C2CCC(=C)C2C1

Molecular Weight¹

204.35

Other Names

• «beta»-Guaijene

• 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°	265.47	kJ/mol	Joback Calculated Property
ΔfH°gas	-72.77	kJ/mol	Joback Calculated Property
ΔfusH°	20.87	kJ/mol	Joback Calculated Property
ΔvapH°	48.45	kJ/mol	Joback Calculated Property
log10WS	-4.63		Crippen Calculated Property
logPoct/wat	4.581		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Pc	1893.65	kPa	Joback Calculated Property
Inp	[1446.00; 1500.00]
Inp	1500.00		NIST
Inp	1482.00		NIST
Inp	1500.00		NIST
Inp	1446.00		NIST
Inp	1482.00		NIST
I	1658.00		NIST
Tboil	559.54	K	Joback Calculated Property
Tc	774.32	K	Joback Calculated Property
Tfus	270.09	K	Joback Calculated Property
Vc	0.722	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[499.46; 625.06]	J/mol×K	[559.54; 774.32]
Cp,gas	499.46	J/mol×K	559.54	Joback Calculated Property
Cp,gas	523.74	J/mol×K	595.34	Joback Calculated Property
Cp,gas	546.61	J/mol×K	631.13	Joback Calculated Property
Cp,gas	568.13	J/mol×K	666.93	Joback Calculated Property
Cp,gas	588.34	J/mol×K	702.73	Joback Calculated Property
Cp,gas	607.30	J/mol×K	738.53	Joback Calculated Property
Cp,gas	625.06	J/mol×K	774.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Guajene.

Sources

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

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