Chemical Properties of 10-epi-«alpha»-Muurolol (T-Muurolol)

InChI

InChI=1S/C15H28O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h10-14,16H,5-9H2,1-4H3/t11?,12-,13?,14?,15-/m0/s1

InChI Key

RYSZDRWMTKGBFI-HONHCDKBSA-N

Formula

C15H28O

SMILES

CC1CCC2C(C1)C(C(C)C)CCC2(C)O

Molecular Weight¹

224.38

• 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	0.5433		Relay (1.0) Calculated Property
ΔfG°	-19.36	kJ/mol	Joback Calculated Property
ΔfH°gas	-404.90	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.96	kJ/mol	Joback Calculated Property
ΔvapH°	83.23	kJ/mol	Relay (1.0) Calculated Property
IE	8.97	eV	Relay (1.0) Calculated Property
log10WS	-4.72		Relay (1.0) Calculated Property
logPoct/wat	3.856		Crippen Calculated Property
McVol	206.360	ml/mol	McGowan Calculated Property
Pc	1971.80	kPa	Joback Calculated Property
Inp	[1638.00; 1639.00]
Inp	1639.00		NIST
Inp	1638.00		NIST
Tboil	558.61	K	Relay (1.0) Calculated Property
Tc	779.98	K	Relay (1.0) Calculated Property
Tfus	337.50	K	Relay (1.0) Calculated Property
Vc	0.723	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[621.88; 737.04]	J/mol×K	[651.13; 853.71]
Cp,gas	621.88	J/mol×K	651.13	Joback Calculated Property
Cp,gas	643.47	J/mol×K	684.89	Joback Calculated Property
Cp,gas	663.95	J/mol×K	718.66	Joback Calculated Property
Cp,gas	683.44	J/mol×K	752.42	Joback Calculated Property
Cp,gas	702.05	J/mol×K	786.19	Joback Calculated Property
Cp,gas	719.88	J/mol×K	819.95	Joback Calculated Property
Cp,gas	737.04	J/mol×K	853.71	Joback Calculated Property

Similar Compounds

Find more compounds similar to 10-epi-«alpha»-Muurolol (T-Muurolol).

Sources

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

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