Chemical Properties of Phenol, 4-(1,1,2,3,3-pentamethylbutyl)

InChI

InChI=1S/C15H24O/c1-11(14(2,3)4)15(5,6)12-7-9-13(16)10-8-12/h7-11,16H,1-6H3

InChI Key

FESTUJZLOUTDRN-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC(C(C)(C)C)C(C)(C)c1ccc(O)cc1

Molecular Weight¹

220.35

• 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_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°	36.45	kJ/mol	Joback Calculated Property
ΔfH°gas	-316.49	kJ/mol	Joback Calculated Property
ΔfusH°	16.08	kJ/mol	Joback Calculated Property
ΔvapH°	61.29	kJ/mol	Joback Calculated Property
log10WS	-3.94		Crippen Calculated Property
logPoct/wat	4.352		Crippen Calculated Property
McVol	204.320	ml/mol	McGowan Calculated Property
Pc	2200.01	kPa	Joback Calculated Property
Inp	[1752.00; 1752.00]
Inp	1752.00		NIST
Inp	1752.00		NIST
Tboil	643.00	K	Joback Calculated Property
Tc	872.59	K	Joback Calculated Property
Tfus	386.79	K	Joback Calculated Property
Vc	0.706	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[563.77; 658.94]	J/mol×K	[643.00; 872.59]
Cp,gas	563.77	J/mol×K	643.00	Joback Calculated Property
Cp,gas	582.53	J/mol×K	681.26	Joback Calculated Property
Cp,gas	599.92	J/mol×K	719.53	Joback Calculated Property
Cp,gas	616.10	J/mol×K	757.79	Joback Calculated Property
Cp,gas	631.22	J/mol×K	796.06	Joback Calculated Property
Cp,gas	645.45	J/mol×K	834.32	Joback Calculated Property
Cp,gas	658.94	J/mol×K	872.59	Joback Calculated Property
η	[0.0000141; 0.0019516]	Pa×s	[386.79; 643.00]
η	0.0019516	Pa×s	386.79	Joback Calculated Property
η	0.0005700	Pa×s	429.49	Joback Calculated Property
η	0.0002080	Pa×s	472.19	Joback Calculated Property
η	0.0000897	Pa×s	514.89	Joback Calculated Property
η	0.0000440	Pa×s	557.60	Joback Calculated Property
η	0.0000239	Pa×s	600.30	Joback Calculated Property
η	0.0000141	Pa×s	643.00	Joback Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 4-(1,1,2,3,3-pentamethylbutyl).

Sources

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

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