Chemical Properties of Pyrene, 1-decylhexadecahydro- (CAS 55191-41-8)

InChI

InChI=1S/C26H46/c1-2-3-4-5-6-7-8-9-11-20-14-15-23-17-16-21-12-10-13-22-18-19-24(20)26(23)25(21)22/h20-26H,2-19H2,1H3

InChI Key

DEVZYFUPAIBVPP-UHFFFAOYSA-N

Formula

C26H46

SMILES

CCCCCCCCCCC1CCC2CCC3CCCC4CCC1C2C34

Molecular Weight¹

358.64

CAS

55191-41-8

Other Names

• 3-n-Decyl-(hexadecahydropyrene)
• 3-n-Decylperhydropyrene

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• 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

Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1186.12; 1323.29]	J/mol×K	[824.51; 1028.45]
Cp,gas	1186.12	J/mol×K	824.51	Joback Calculated Property
Cp,gas	1212.38	J/mol×K	858.50	Joback Calculated Property
Cp,gas	1237.12	J/mol×K	892.49	Joback Calculated Property
Cp,gas	1260.47	J/mol×K	926.48	Joback Calculated Property
Cp,gas	1282.53	J/mol×K	960.47	Joback Calculated Property
Cp,gas	1303.43	J/mol×K	994.46	Joback Calculated Property
Cp,gas	1323.29	J/mol×K	1028.45	Joback Calculated Property
η	[0.0018781; 0.0046488]	Pa×s	[427.74; 824.51]
η	0.0046488	Pa×s	427.74	Joback Calculated Property
η	0.0036126	Pa×s	493.87	Joback Calculated Property
η	0.0029796	Pa×s	560.00	Joback Calculated Property
η	0.0025596	Pa×s	626.12	Joback Calculated Property
η	0.0022635	Pa×s	692.25	Joback Calculated Property
η	0.0020451	Pa×s	758.38	Joback Calculated Property
η	0.0018781	Pa×s	824.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to Pyrene, 1-decylhexadecahydro-.

Sources

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

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