Chemical Properties of «beta»-Copaen-4-ol

InChI

InChI=1S/C15H24O/c1-8(2)10-5-6-15(4)11-7-12(16)9(3)14(15)13(10)11/h8,10-14,16H,3,5-7H2,1-2,4H3/t10-,11?,12-,13?,14?,15-/m0/s1

InChI Key

LPXOPRGPLUWGKB-VXLSKKRHSA-N

Formula

C15H24O

SMILES

C=C1C(O)CC2C3C(C(C)C)CCC2(C)C13

Molecular Weight¹

220.35

• 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°	130.77	kJ/mol	Joback Calculated Property
ΔfH°gas	-259.74	kJ/mol	Joback Calculated Property
ΔfusH°	23.23	kJ/mol	Joback Calculated Property
ΔvapH°	63.27	kJ/mol	Joback Calculated Property
log10WS	-3.56		Crippen Calculated Property
logPoct/wat	3.242		Crippen Calculated Property
McVol	191.200	ml/mol	McGowan Calculated Property
Pc	2108.07	kPa	Joback Calculated Property
Inp	[1566.00; 1585.00]
Inp	1584.00		NIST
Inp	1566.00		NIST
Inp	1584.00		NIST
Inp	1585.00		NIST
Inp	1574.00		NIST
Inp	1574.00		NIST
Inp	1566.00		NIST
Tboil	644.22	K	Joback Calculated Property
Tc	842.77	K	Joback Calculated Property
Tfus	379.79	K	Joback Calculated Property
Vc	0.731	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[576.73; 677.43]	J/mol×K	[644.22; 842.77]
Cp,gas	576.73	J/mol×K	644.22	Joback Calculated Property
Cp,gas	595.44	J/mol×K	677.31	Joback Calculated Property
Cp,gas	613.20	J/mol×K	710.40	Joback Calculated Property
Cp,gas	630.15	J/mol×K	743.49	Joback Calculated Property
Cp,gas	646.41	J/mol×K	776.58	Joback Calculated Property
Cp,gas	662.12	J/mol×K	809.68	Joback Calculated Property
Cp,gas	677.43	J/mol×K	842.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Copaen-4-ol.

Sources

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

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