Chemical Properties of Perhydrophenanthrene, 1-ethyl-4bB,8,8,10aB-tetramethyl

InChI

InChI=1S/C20H36/c1-6-15-9-7-10-17-19(15,4)14-11-16-18(2,3)12-8-13-20(16,17)5/h15-17H,6-14H2,1-5H3/t15?,16?,17?,19-,20-/m0/s1

InChI Key

OLOGNINMFUDASI-GTSVPISWSA-N

Formula

C20H36

SMILES

CCC1CCCC2C1(C)CCC1C(C)(C)CCCC12C

Molecular Weight¹

276.50

• 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	0.4072		Relay (... Calculated Property
ΔfG°	199.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-270.00	kJ/mol	Relay (... Calculated Property
ΔfusH°	15.78	kJ/mol	Joback Calculated Property
ΔvapH°	80.49	kJ/mol	Relay (... Calculated Property
IE	8.59	eV	Relay (... Calculated Property
log10WS	-6.84		Relay (... Calculated Property
logPoct/wat	6.445		Crippen Calculated Property
McVol	260.080	ml/mol	McGowan Calculated Property
Pc	1494.19	kPa	Joback Calculated Property
Inp	[2061.00; 2061.00]
Inp	2061.00		NIST
Inp	2061.00		NIST
Tboil	601.55	K	Relay (... Calculated Property
Tc	840.17	K	Relay (... Calculated Property
Tfus	314.81	K	Relay (... Calculated Property
Vc	0.928	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[811.77; 977.79]	J/mol×K	[685.28; 917.18]
Cp,gas	811.77	J/mol×K	685.28	Joback Calculated Property
Cp,gas	840.70	J/mol×K	723.93	Joback Calculated Property
Cp,gas	868.58	J/mol×K	762.58	Joback Calculated Property
Cp,gas	895.82	J/mol×K	801.23	Joback Calculated Property
Cp,gas	922.83	J/mol×K	839.88	Joback Calculated Property
Cp,gas	950.02	J/mol×K	878.53	Joback Calculated Property
Cp,gas	977.79	J/mol×K	917.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to Perhydrophenanthrene, 1-ethyl-4bB,8,8,10aB-tetramethyl.

Sources

• Cheméo Relay (1.0)
• 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.