Chemical Properties of Phenol, 2,5-bis(1-methylpropyl)-

InChI

InChI=1S/C14H22O/c1-5-10(3)12-7-8-13(11(4)6-2)14(15)9-12/h7-11,15H,5-6H2,1-4H3

InChI Key

USKPGPJXOGQXMS-UHFFFAOYSA-N

Formula

C14H22O

SMILES

CCC(C)c1ccc(C(C)CC)c(O)c1

Molecular Weight¹

206.33

Other Names

• 2,5-Disec-butylphenol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[264.03; 643.53]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-4.17280e+01
Coefficient B			1.36188e+00
Coefficient C			-9.64720e-04
Coefficient D			2.88100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	264.03	J/mol×K	273.00	Calculated Property
Cp,gas	332.09	J/mol×K	353.78	Calculated Property
Cp,gas	391.55	J/mol×K	434.56	Calculated Property
Cp,gas	443.32	J/mol×K	515.33	Calculated Property
Cp,gas	488.32	J/mol×K	596.11	Calculated Property
Cp,gas	527.45	J/mol×K	676.89	Calculated Property
Cp,gas	561.62	J/mol×K	757.67	Calculated Property
Cp,gas	591.76	J/mol×K	838.44	Calculated Property
Cp,gas	618.75	J/mol×K	919.22	Calculated Property
Cp,gas	643.53	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0023539; 0.0000318]	Pa×s	[368.20; 591.51]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.74565e+01
Coefficient B			4.19926e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			368.20
Temperature range, max.			591.51
η	0.0023539	Pa×s	368.20	Calculated Property
η	0.0011457	Pa×s	393.01	Calculated Property
η	0.0006075	Pa×s	417.82	Calculated Property
η	0.0003458	Pa×s	442.64	Calculated Property
η	0.0002090	Pa×s	467.45	Calculated Property
η	0.0001329	Pa×s	492.26	Calculated Property
η	0.0000883	Pa×s	517.07	Calculated Property
η	0.0000608	Pa×s	541.89	Calculated Property
η	0.0000433	Pa×s	566.70	Calculated Property
η	0.0000318	Pa×s	591.51	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2,5-bis(1-methylpropyl)-.

Sources

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

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