Chemical Properties of 2H-2,4a-Ethanonaphthalene, 1,3,4,5,6,7-hexahydro-2,5,5-trimethyl- (CAS 32391-44-9)

InChI

InChI=1S/C15H24/c1-13(2)6-4-5-12-11-14(3)7-9-15(12,13)10-8-14/h5H,4,6-11H2,1-3H3

InChI Key

UMLOXPMLISZBGS-UHFFFAOYSA-N

Formula

C15H24

SMILES

CC12CCC3(CC1)C(=CCCC3(C)C)C2

Molecular Weight¹

204.35

CAS

32391-44-9

Other Names

• 2,5,5-Trimethyl-2,3,4,5,6,7-hexahydro-1H-2,4a-ethanonaphthalene

• 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	0.3054		Relay (... Calculated Property
ΔfG°	225.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-41.05	kJ/mol	Relay (... Calculated Property
ΔfusH°	4.65	kJ/mol	Joback Calculated Property
ΔvapH°	60.04	kJ/mol	Relay (... Calculated Property
IE	8.00	eV	Relay (... Calculated Property
log10WS	-5.22		Relay (... Calculated Property
logPoct/wat	4.703		Crippen Calculated Property
McVol	185.330	ml/mol	McGowan Calculated Property
Pc	2410.00	kPa	Joback Calculated Property
Inp	[1456.40; 1456.40]
Inp	1456.40		NIST
Inp	1456.40		NIST
Tboil	528.82	K	Relay (... Calculated Property
Tc	773.77	K	Relay (... Calculated Property
Tfus	420.21	K	Relay (... Calculated Property
Vc	0.657	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[502.17; 624.39]	J/mol×K	[580.49; 823.96]
Cp,gas	502.17	J/mol×K	580.49	Joback Calculated Property
Cp,gas	525.02	J/mol×K	621.07	Joback Calculated Property
Cp,gas	546.22	J/mol×K	661.65	Joback Calculated Property
Cp,gas	566.25	J/mol×K	702.22	Joback Calculated Property
Cp,gas	585.62	J/mol×K	742.80	Joback Calculated Property
Cp,gas	604.84	J/mol×K	783.38	Joback Calculated Property
Cp,gas	624.39	J/mol×K	823.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2H-2,4a-Ethanonaphthalene, 1,3,4,5,6,7-hexahydro-2,5,5-trimethyl-.

Sources

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

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