Chemical Properties of 10-epi-«gamma»-eudesmol acetate

InChI

InChI=1S/C17H28O2/c1-12-7-6-9-17(5)10-8-14(11-15(12)17)16(3,4)19-13(2)18/h14H,6-11H2,1-5H3/t14-,17+/m0/s1

InChI Key

WJUQDFFDADGYQZ-WMLDXEAASA-N

Formula

C17H28O2

SMILES

CC(=O)OC(C)(C)C1CCC2(C)CCCC(C)=C2C1

Molecular Weight¹

264.40

• 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	0.4573		Relay (1.0) Calculated Property
ΔfG°	-60.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-505.97	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	17.18	kJ/mol	Joback Calculated Property
ΔvapH°	80.19	kJ/mol	Relay (1.0) Calculated Property
IE	8.08	eV	Relay (1.0) Calculated Property
log10WS	-3.80		Relay (1.0) Calculated Property
logPoct/wat	4.635		Crippen Calculated Property
McVol	231.810	ml/mol	McGowan Calculated Property
Pc	1774.35	kPa	Joback Calculated Property
Inp	[1741.00; 1741.00]
Inp	1741.00		NIST
Inp	1741.00		NIST
Tboil	564.89	K	Relay (1.0) Calculated Property
Tc	798.10	K	Relay (1.0) Calculated Property
Tfus	319.96	K	Relay (1.0) Calculated Property
Vc	0.818	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[691.67; 808.32]	J/mol×K	[701.34; 927.04]
Cp,gas	691.67	J/mol×K	701.34	Joback Calculated Property
Cp,gas	713.43	J/mol×K	738.96	Joback Calculated Property
Cp,gas	734.03	J/mol×K	776.57	Joback Calculated Property
Cp,gas	753.66	J/mol×K	814.19	Joback Calculated Property
Cp,gas	772.46	J/mol×K	851.81	Joback Calculated Property
Cp,gas	790.63	J/mol×K	889.42	Joback Calculated Property
Cp,gas	808.32	J/mol×K	927.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to 10-epi-«gamma»-eudesmol acetate.

Sources

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

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