Chemical Properties of (+)-Muurolan-4,7-peroxide

InChI

InChI=1S/C15H26O2/c1-10(2)15-8-5-11(3)12-6-7-14(4,16-17-15)9-13(12)15/h10-13H,5-9H2,1-4H3/t11-,12+,13?,14?,15+/m0/s1

InChI Key

IGPMTDORMOJTHZ-FKQQDJLNSA-N

Formula

C15H26O2

SMILES

CC1CCC2(C(C)C)OOC3(C)CCC1C2C3

Molecular Weight¹

238.37

• 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°	20.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-432.49	kJ/mol	Joback Calculated Property
ΔfusH°	24.69	kJ/mol	Joback Calculated Property
ΔvapH°	54.95	kJ/mol	Joback Calculated Property
log10WS	-4.21		Crippen Calculated Property
logPoct/wat	3.948		Crippen Calculated Property
McVol	201.370	ml/mol	McGowan Calculated Property
Pc	2106.13	kPa	Joback Calculated Property
Inp	[1485.00; 1485.00]
Inp	1485.00		NIST
Inp	1485.00		NIST
Tboil	620.23	K	Joback Calculated Property
Tc	849.95	K	Joback Calculated Property
Tfus	379.53	K	Joback Calculated Property
Vc	0.752	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[597.39; 724.09]	J/mol×K	[620.23; 849.95]
Cp,gas	597.39	J/mol×K	620.23	Joback Calculated Property
Cp,gas	620.95	J/mol×K	658.52	Joback Calculated Property
Cp,gas	643.13	J/mol×K	696.80	Joback Calculated Property
Cp,gas	664.23	J/mol×K	735.09	Joback Calculated Property
Cp,gas	684.56	J/mol×K	773.38	Joback Calculated Property
Cp,gas	704.41	J/mol×K	811.67	Joback Calculated Property
Cp,gas	724.09	J/mol×K	849.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to (+)-Muurolan-4,7-peroxide.

Sources

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

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