Chemical Properties of 1«alpha»,4«alpha»,7«alpha»-Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethyl)

InChI

InChI=1S/C15H26/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h10-13H,5-9H2,1-4H3/t11-,12-,13+/m1/s1

InChI Key

XURCUMFVQKJMJP-UPJWGTAASA-N

Formula

C15H26

SMILES

CC1CCC(C(C)C)CC2=C1CCC2C

Molecular Weight¹

206.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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 : 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°	149.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-222.75	kJ/mol	Joback Calculated Property
ΔfusH°	20.47	kJ/mol	Joback Calculated Property
ΔvapH°	50.42	kJ/mol	Joback Calculated Property
log10WS	-4.78		Crippen Calculated Property
logPoct/wat	4.805		Crippen Calculated Property
McVol	196.190	ml/mol	McGowan Calculated Property
Pc	1862.72	kPa	Joback Calculated Property
I	[1592.00; 1592.00]
I	1592.00		NIST
I	1592.00		NIST
Tboil	577.17	K	Joback Calculated Property
Tc	790.56	K	Joback Calculated Property
Tfus	287.17	K	Joback Calculated Property
Vc	0.737	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[523.34; 647.13]	J/mol×K	[577.17; 790.56]
Cp,gas	523.34	J/mol×K	577.17	Joback Calculated Property
Cp,gas	547.18	J/mol×K	612.74	Joback Calculated Property
Cp,gas	569.68	J/mol×K	648.30	Joback Calculated Property
Cp,gas	590.87	J/mol×K	683.87	Joback Calculated Property
Cp,gas	610.82	J/mol×K	719.43	Joback Calculated Property
Cp,gas	629.55	J/mol×K	755.00	Joback Calculated Property
Cp,gas	647.13	J/mol×K	790.56	Joback Calculated Property
η	[0.0003337; 0.0024375]	Pa×s	[287.17; 577.17]
η	0.0024375	Pa×s	287.17	Joback Calculated Property
η	0.0013783	Pa×s	335.50	Joback Calculated Property
η	0.0008997	Pa×s	383.84	Joback Calculated Property
η	0.0006461	Pa×s	432.17	Joback Calculated Property
η	0.0004959	Pa×s	480.50	Joback Calculated Property
η	0.0003995	Pa×s	528.84	Joback Calculated Property
η	0.0003337	Pa×s	577.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1«alpha»,4«alpha»,7«alpha»-Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethyl).

Sources

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

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