Chemical Properties of Panaxene (CAS 871660-95-6)

InChI

InChI=1S/C15H24/c1-7-14(6)9-8-12-13(4,5)10-15(12,14)11(2)3/h7,12H,1-2,8-10H2,3-6H3

InChI Key

UAOBSVDFJSNTLJ-UHFFFAOYSA-N

Formula

C15H24

SMILES

C=CC1(C)CCC2C(C)(C)CC21C(=C)C

Molecular Weight¹

204.35

CAS

871660-95-6

• 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	0.2948		Relay (... Calculated Property
ΔfG°	320.06	kJ/mol	Joback Calculated Property
ΔfH°gas	36.15	kJ/mol	Relay (... Calculated Property
ΔfusH°	8.15	kJ/mol	Joback Calculated Property
ΔvapH°	60.52	kJ/mol	Relay (... Calculated Property
IE	8.38	eV	Relay (... Calculated Property
log10WS	-5.27		Relay (... Calculated Property
logPoct/wat	4.581		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Pc	2038.23	kPa	Joback Calculated Property
Inp	[1312.00; 1313.60]
Inp	1313.60		NIST
Inp	1313.60		NIST
Inp	1312.00		NIST
Tboil	510.51	K	Relay (... Calculated Property
Tc	734.61	K	Relay (... Calculated Property
Tfus	288.24	K	Relay (... Calculated Property
Vc	0.653	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[491.98; 604.73]	J/mol×K	[544.97; 765.66]
Cp,gas	491.98	J/mol×K	544.97	Joback Calculated Property
Cp,gas	513.69	J/mol×K	581.75	Joback Calculated Property
Cp,gas	533.75	J/mol×K	618.53	Joback Calculated Property
Cp,gas	552.52	J/mol×K	655.31	Joback Calculated Property
Cp,gas	570.37	J/mol×K	692.10	Joback Calculated Property
Cp,gas	587.65	J/mol×K	728.88	Joback Calculated Property
Cp,gas	604.73	J/mol×K	765.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to Panaxene.

Sources

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

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