Chemical Properties of Eremophila-1(10),7(11)-dien-2-«alpha»-ol

InChI

InChI=1S/C15H24O/c1-10(2)12-5-6-13-7-8-14(16)11(3)15(13,4)9-12/h13-14,16H,3,5-9H2,1-2,4H3/t13?,14-,15+/m0/s1

InChI Key

ZRRALBDIFLTORZ-NOYMGPGASA-N

Formula

C15H24O

SMILES

C=C1C(O)CCC2CCC(=C(C)C)CC12C

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.
• 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	0.4470		Relay (1.0) Calculated Property
ΔfG°	88.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-228.85	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.19	kJ/mol	Joback Calculated Property
ΔvapH°	88.40	kJ/mol	Relay (1.0) Calculated Property
IE	8.34	eV	Relay (1.0) Calculated Property
log10WS	-3.37		Relay (1.0) Calculated Property
logPoct/wat	3.840		Crippen Calculated Property
McVol	197.760	ml/mol	McGowan Calculated Property
Pc	2181.56	kPa	Joback Calculated Property
Inp	[1771.00; 1771.00]
Inp	1771.00		NIST
Inp	1771.00		NIST
Tboil	576.52	K	Relay (1.0) Calculated Property
Tc	791.49	K	Relay (1.0) Calculated Property
Tfus	393.29	K	Relay (1.0) Calculated Property
Vc	0.668	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[572.00; 673.03]	J/mol×K	[666.59; 875.76]
Cp,gas	572.00	J/mol×K	666.59	Joback Calculated Property
Cp,gas	590.73	J/mol×K	701.45	Joback Calculated Property
Cp,gas	608.54	J/mol×K	736.31	Joback Calculated Property
Cp,gas	625.54	J/mol×K	771.17	Joback Calculated Property
Cp,gas	641.88	J/mol×K	806.04	Joback Calculated Property
Cp,gas	657.66	J/mol×K	840.90	Joback Calculated Property
Cp,gas	673.03	J/mol×K	875.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Eremophila-1(10),7(11)-dien-2-«alpha»-ol.

Sources

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

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