Chemical Properties of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenyl ester

InChI

InChI=1S/C17H12O3/c18-16-11-13-7-5-4-6-12(13)10-15(16)17(19)20-14-8-2-1-3-9-14/h1-11,18H

InChI Key

SRMZHGJLSDITLO-UHFFFAOYSA-N

Formula

C17H12O3

SMILES

O=C(Oc1ccccc1)c1cc2ccccc2cc1O

Molecular Weight¹

264.28

Other Names

• 2-Naphthoic acid, 3-hydroxy-, phenyl ester
• Phenyl 3-hydroxy-2-naphthoate
• Phenyl-2-hydroxy-3-naphthoate

• 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_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[246.38; 596.03]	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			-8.10300e+01
Coefficient B			1.49760e+00
Coefficient C			-1.19484e-03
Coefficient D			3.74300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	246.38	J/mol×K	273.00	Calculated Property
Cp,gas	315.82	J/mol×K	353.78	Calculated Property
Cp,gas	374.84	J/mol×K	434.56	Calculated Property
Cp,gas	424.65	J/mol×K	515.33	Calculated Property
Cp,gas	466.41	J/mol×K	596.11	Calculated Property
Cp,gas	501.31	J/mol×K	676.89	Calculated Property
Cp,gas	530.54	J/mol×K	757.67	Calculated Property
Cp,gas	555.28	J/mol×K	838.44	Calculated Property
Cp,gas	576.72	J/mol×K	919.22	Calculated Property
Cp,gas	596.03	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001893; 0.0000168]	Pa×s	[533.46; 746.14]	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			-1.70670e+01
Coefficient B			4.53168e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			533.46
Temperature range, max.			746.14
η	0.0001893	Pa×s	533.46	Calculated Property
η	0.0001320	Pa×s	557.09	Calculated Property
η	0.0000948	Pa×s	580.72	Calculated Property
η	0.0000699	Pa×s	604.35	Calculated Property
η	0.0000527	Pa×s	627.99	Calculated Property
η	0.0000406	Pa×s	651.62	Calculated Property
η	0.0000318	Pa×s	675.25	Calculated Property
η	0.0000253	Pa×s	698.88	Calculated Property
η	0.0000205	Pa×s	722.51	Calculated Property
η	0.0000168	Pa×s	746.14	Calculated Property

Similar Compounds

Find more compounds similar to 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenyl ester.

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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