Chemical Properties of Panaginsene (CAS 871660-96-7)

InChI

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

InChI Key

ZRXJARPSARBQCO-UHFFFAOYSA-N

Formula

C15H24

SMILES

CC1=C2CC(C)(C)C3CCC(C)C23CC1

Molecular Weight¹

204.35

CAS

871660-96-7

• 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°	225.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-101.87	kJ/mol	Joback Calculated Property
ΔfusH°	13.73	kJ/mol	Joback Calculated Property
ΔvapH°	48.07	kJ/mol	Joback Calculated Property
log10WS	-4.67		Crippen Calculated Property
logPoct/wat	4.559		Crippen Calculated Property
McVol	185.330	ml/mol	McGowan Calculated Property
Pc	2153.30	kPa	Joback Calculated Property
Inp	[1336.00; 1337.90]
Inp	1337.90		NIST
Inp	1336.00		NIST
Inp	1337.90		NIST
Tboil	576.29	K	Joback Calculated Property
Tc	802.89	K	Joback Calculated Property
Tfus	374.95	K	Joback Calculated Property
Vc	0.712	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[503.46; 619.93]	J/mol×K	[576.29; 802.89]
Cp,gas	503.46	J/mol×K	576.29	Joback Calculated Property
Cp,gas	525.54	J/mol×K	614.06	Joback Calculated Property
Cp,gas	546.15	J/mol×K	651.82	Joback Calculated Property
Cp,gas	565.60	J/mol×K	689.59	Joback Calculated Property
Cp,gas	584.18	J/mol×K	727.36	Joback Calculated Property
Cp,gas	602.19	J/mol×K	765.12	Joback Calculated Property
Cp,gas	619.93	J/mol×K	802.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to Panaginsene.

Sources

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

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