Chemical Properties of Jinkho-eremol

InChI

InChI=1S/C15H26O/c1-11-6-5-7-12-8-9-13(14(2,3)16)10-15(11,12)4/h5,7,11-13,16H,6,8-10H2,1-4H3/t11-,12?,13+,15+/m1/s1

InChI Key

STRWISYROJVASE-YKURLNKLSA-N

Formula

C15H26O

SMILES

CC1CC=CC2CCC(C(C)(C)O)CC12C

Molecular Weight¹

222.37

• 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°	23.59	kJ/mol	Joback Calculated Property
ΔfH°gas	-360.61	kJ/mol	Joback Calculated Property
ΔfusH°	16.22	kJ/mol	Joback Calculated Property
ΔvapH°	63.40	kJ/mol	Joback Calculated Property
log10WS	-4.15		Crippen Calculated Property
logPoct/wat	3.776		Crippen Calculated Property
McVol	202.060	ml/mol	McGowan Calculated Property
Pc	2119.73	kPa	Joback Calculated Property
Inp	[1642.00; 1643.00]
Inp	1642.00		NIST
Inp	1643.00		NIST
Tboil	652.17	K	Joback Calculated Property
Tc	863.51	K	Joback Calculated Property
Tfus	360.03	K	Joback Calculated Property
Vc	0.748	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[599.78; 708.96]	J/mol×K	[652.17; 863.51]
Cp,gas	599.78	J/mol×K	652.17	Joback Calculated Property
Cp,gas	620.42	J/mol×K	687.39	Joback Calculated Property
Cp,gas	639.88	J/mol×K	722.62	Joback Calculated Property
Cp,gas	658.32	J/mol×K	757.84	Joback Calculated Property
Cp,gas	675.87	J/mol×K	793.06	Joback Calculated Property
Cp,gas	692.70	J/mol×K	828.29	Joback Calculated Property
Cp,gas	708.96	J/mol×K	863.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to Jinkho-eremol.

Sources

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

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