Chemical Properties of Opposita-4(15),7(11)-dien-1«beta»-ol

InChI

InChI=1S/C15H24O/c1-10(2)9-12-7-8-15(4)13(16)6-5-11(3)14(12)15/h9,12-14,16H,3,5-8H2,1-2,4H3/t12-,13-,14?,15+/m1/s1

InChI Key

CZFKRGCIADMIRY-VOFREWHGSA-N

Formula

C15H24O

SMILES

C=C1CCC(O)C2(C)CCC(C=C(C)C)C12

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_np : Non-polar retention indices.
• 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	0.4657		Relay (1.0) Calculated Property
ΔfG°	127.64	kJ/mol	Joback Calculated Property
ΔfH°gas	-215.71	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.24	kJ/mol	Joback Calculated Property
ΔvapH°	88.68	kJ/mol	Relay (1.0) Calculated Property
IE	8.33	eV	Relay (1.0) Calculated Property
log10WS	-3.93		Relay (1.0) Calculated Property
logPoct/wat	3.696		Crippen Calculated Property
McVol	197.760	ml/mol	McGowan Calculated Property
Pc	2111.94	kPa	Joback Calculated Property
Inp	[1620.00; 1636.00]
Inp	1636.00		NIST
Inp	1620.00		NIST
I	[2314.00; 2314.00]
I	2314.00		NIST
I	2314.00		NIST
Tboil	565.25	K	Relay (1.0) Calculated Property
Tc	779.91	K	Relay (1.0) Calculated Property
Tfus	358.71	K	Relay (1.0) Calculated Property
Vc	0.659	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[572.15; 673.41]	J/mol×K	[655.17; 860.33]
Cp,gas	572.15	J/mol×K	655.17	Joback Calculated Property
Cp,gas	590.96	J/mol×K	689.36	Joback Calculated Property
Cp,gas	608.83	J/mol×K	723.56	Joback Calculated Property
Cp,gas	625.87	J/mol×K	757.75	Joback Calculated Property
Cp,gas	642.23	J/mol×K	791.94	Joback Calculated Property
Cp,gas	658.03	J/mol×K	826.14	Joback Calculated Property
Cp,gas	673.41	J/mol×K	860.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Opposita-4(15),7(11)-dien-1«beta»-ol.

Sources

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

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