Chemical Properties of Phenol, 2-[(4-hydroxyphenyl)methyl]- (CAS 2467-03-0)

InChI

InChI=1S/C13H12O2/c14-12-7-5-10(6-8-12)9-11-3-1-2-4-13(11)15/h1-8,14-15H,9H2

InChI Key

LVLNPXCISNPHLE-UHFFFAOYSA-N

Formula

C13H12O2

SMILES

Oc1ccc(Cc2ccccc2O)cc1

Molecular Weight¹

200.23

CAS

2467-03-0

Other Names

• (2-Hydroxyphenyl)(4-hydroxyphenyl)methane
• 2,4'-Dihydroxydiphenylmethane
• 2,4'-Methylenebis(phenol)
• 2,4'-Methylenediphenol
• Phenol, 2,4'-methylenedi-
• o-(p-Hydroxybenzyl)phenol
• o-[(4-hydroxyphenyl)methyl]phenol

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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 Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[200.52; 497.80]	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			-9.45790e+01
Coefficient B			1.39020e+00
Coefficient C			-1.25852e-03
Coefficient D			4.60700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	200.52	J/mol×K	273.00	Calculated Property
Cp,gas	260.13	J/mol×K	353.78	Calculated Property
Cp,gas	309.69	J/mol×K	434.56	Calculated Property
Cp,gas	350.66	J/mol×K	515.33	Calculated Property
Cp,gas	384.51	J/mol×K	596.11	Calculated Property
Cp,gas	412.68	J/mol×K	676.89	Calculated Property
Cp,gas	436.64	J/mol×K	757.67	Calculated Property
Cp,gas	457.85	J/mol×K	838.44	Calculated Property
Cp,gas	477.75	J/mol×K	919.22	Calculated Property
Cp,gas	497.80	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000572; 0.0000023]	Pa×s	[512.55; 681.39]	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			-2.26975e+01
Coefficient B			6.62692e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			512.55
Temperature range, max.			681.39
η	0.0000572	Pa×s	512.55	Calculated Property
η	0.0000363	Pa×s	531.31	Calculated Property
η	0.0000237	Pa×s	550.07	Calculated Property
η	0.0000159	Pa×s	568.83	Calculated Property
η	0.0000110	Pa×s	587.59	Calculated Property
η	0.0000077	Pa×s	606.35	Calculated Property
η	0.0000056	Pa×s	625.11	Calculated Property
η	0.0000041	Pa×s	643.87	Calculated Property
η	0.0000031	Pa×s	662.63	Calculated Property
η	0.0000023	Pa×s	681.39	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2-[(4-hydroxyphenyl)methyl]-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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