Chemical Properties of cycloeucalane (CAS 469-40-9)

InChI

InChI=1S/C30H52/c1-20(2)21(3)10-11-23(5)24-14-16-28(7)26-13-12-25-22(4)9-8-15-29(25)19-30(26,29)18-17-27(24,28)6/h20-26H,8-19H2,1-7H3/t21-,22+,23+,24+,25-,26-,27+,28-,29+,30-/m1/s1

InChI Key

GYQYLPXFYDCSFX-YPOKRKHXSA-N

Formula

C30H52

SMILES

CC(C)C(C)CCC(C)C1CCC2(C)C3CCC4C(C)CCCC45CC35CCC12C

Molecular Weight¹

412.73

CAS

469-40-9

• 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°	416.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-332.91	kJ/mol	Joback Calculated Property
ΔfusH°	25.28	kJ/mol	Joback Calculated Property
ΔvapH°	75.76	kJ/mol	Joback Calculated Property
log10WS	-9.20		Crippen Calculated Property
logPoct/wat	9.134		Crippen Calculated Property
McVol	379.260	ml/mol	McGowan Calculated Property
Pc	936.35	kPa	Joback Calculated Property
Inp	[3040.00; 3092.00]
Inp	3043.00		NIST
Inp	3040.00		NIST
Inp	3092.00		NIST
Tboil	917.94	K	Joback Calculated Property
Tc	1148.01	K	Joback Calculated Property
Tfus	544.88	K	Joback Calculated Property
Vc	1.448	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1431.63; 1724.28]	J/mol×K	[917.94; 1148.01]
Cp,gas	1431.63	J/mol×K	917.94	Joback Calculated Property
Cp,gas	1472.52	J/mol×K	956.28	Joback Calculated Property
Cp,gas	1515.72	J/mol×K	994.63	Joback Calculated Property
Cp,gas	1561.87	J/mol×K	1032.97	Joback Calculated Property
Cp,gas	1611.60	J/mol×K	1071.32	Joback Calculated Property
Cp,gas	1665.52	J/mol×K	1109.66	Joback Calculated Property
Cp,gas	1724.28	J/mol×K	1148.01	Joback Calculated Property

Similar Compounds

Find more compounds similar to cycloeucalane.

Sources

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

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