Chemical Properties of 4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undecan-5-one

InChI

InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h11-13H,1,5-9H2,2-4H3

InChI Key

GWBJPNAWYMBRLQ-UHFFFAOYSA-N

Formula

C15H24O

SMILES

C=C1CCC(=O)C(C)CCC2C1CC2(C)C

Molecular Weight¹

220.35

• 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 : 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	0.3691		Relay (... Calculated Property
ΔfG°	46.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-273.28	kJ/mol	Relay (... Calculated Property
ΔfusH°	14.57	kJ/mol	Joback Calculated Property
ΔvapH°	71.21	kJ/mol	Relay (... Calculated Property
IE	8.80	eV	Relay (... Calculated Property
log10WS	-3.91		Relay (... Calculated Property
logPoct/wat	3.984		Crippen Calculated Property
McVol	197.760	ml/mol	McGowan Calculated Property
Pc	1992.98	kPa	Joback Calculated Property
I	[1941.00; 1941.00]
I	1941.00		NIST
I	1941.00		NIST
Tboil	568.98	K	Relay (... Calculated Property
Tc	790.47	K	Relay (... Calculated Property
Tfus	339.09	K	Relay (... Calculated Property
Vc	0.646	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[565.66; 693.29]	J/mol×K	[635.31; 870.83]
Cp,gas	565.66	J/mol×K	635.31	Joback Calculated Property
Cp,gas	589.99	J/mol×K	674.56	Joback Calculated Property
Cp,gas	612.95	J/mol×K	713.82	Joback Calculated Property
Cp,gas	634.64	J/mol×K	753.07	Joback Calculated Property
Cp,gas	655.19	J/mol×K	792.32	Joback Calculated Property
Cp,gas	674.70	J/mol×K	831.58	Joback Calculated Property
Cp,gas	693.29	J/mol×K	870.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undecan-5-one.

Sources

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

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