Chemical Properties of Copaane

InChI

InChI=1S/C15H26/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h9-14H,5-8H2,1-4H3/t10?,11-,12?,13?,14-,15?/m0/s1

InChI Key

LJVYOZJXUGFDJA-DVZSBNJSSA-N

Formula

C15H26

SMILES

CC(C)C1CCC2(C)C3CCC(C)C2C13

Molecular Weight¹

206.37

• 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.
• 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
ω	0.3721		Relay (... Calculated Property
ΔfG°	214.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-96.25	kJ/mol	Relay (... Calculated Property
ΔfusH°	20.30	kJ/mol	Joback Calculated Property
ΔvapH°	59.00	kJ/mol	Relay (... Calculated Property
IE	8.60	eV	Relay (... Calculated Property
log10WS	-5.98		Relay (... Calculated Property
logPoct/wat	4.351		Crippen Calculated Property
McVol	189.630	ml/mol	McGowan Calculated Property
Pc	1908.57	kPa	Joback Calculated Property
Inp	[1421.00; 1477.00]
Inp	1455.00		NIST
Inp	1421.00		NIST
Inp	1477.00		NIST
Inp	1437.00		NIST
I	[1550.00; 1599.00]
I	1599.00		NIST
I	1550.00		NIST
Tboil	513.65	K	Relay (... Calculated Property
Tc	769.95	K	Relay (... Calculated Property
Tfus	297.64	K	Relay (... Calculated Property
Vc	0.674	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[521.89; 648.71]	J/mol×K	[552.88; 763.56]
Cp,gas	521.89	J/mol×K	552.88	Joback Calculated Property
Cp,gas	546.37	J/mol×K	587.99	Joback Calculated Property
Cp,gas	569.28	J/mol×K	623.11	Joback Calculated Property
Cp,gas	590.81	J/mol×K	658.22	Joback Calculated Property
Cp,gas	611.11	J/mol×K	693.33	Joback Calculated Property
Cp,gas	630.35	J/mol×K	728.44	Joback Calculated Property
Cp,gas	648.71	J/mol×K	763.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to Copaane.

Sources

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

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