Chemical Properties of «beta»-(1-Naphthyl)acrylic acid (CAS 13026-12-5)

InChI

InChI=1S/C13H10O2/c14-13(15)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H,(H,14,15)/b9-8+

InChI Key

WPXMLUUYWNHQOR-CMDGGOBGSA-N

Formula

C13H10O2

SMILES

O=C(O)C=Cc1cccc2ccccc12

Molecular Weight¹

198.22

CAS

13026-12-5

Other Names

• 3-(1-Naphthyl)acrylic acid
• 2-Propenoic acid, 3-(1-naphthalenyl)-
• 1-Naphthaleneacrylic acid

• 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).
• 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_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, Enthalpy of vaporization at standard conditions, 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	[185.18; 457.86]	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			-6.95600e+01
Coefficient B			1.16750e+00
Coefficient C			-9.40680e-04
Coefficient D			3.00600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	185.18	J/mol×K	273.00	Calculated Property
Cp,gas	239.05	J/mol×K	353.78	Calculated Property
Cp,gas	284.81	J/mol×K	434.56	Calculated Property
Cp,gas	323.42	J/mol×K	515.33	Calculated Property
Cp,gas	355.81	J/mol×K	596.11	Calculated Property
Cp,gas	382.94	J/mol×K	676.89	Calculated Property
Cp,gas	405.75	J/mol×K	757.67	Calculated Property
Cp,gas	425.21	J/mol×K	838.44	Calculated Property
Cp,gas	442.27	J/mol×K	919.22	Calculated Property
Cp,gas	457.86	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009938; 0.0002815]	Pa×s	[463.43; 659.73]	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			-1.11526e+01
Coefficient B			1.96430e+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.			463.43
Temperature range, max.			659.73
η	0.0009938	Pa×s	463.43	Calculated Property
η	0.0008214	Pa×s	485.24	Calculated Property
η	0.0006901	Pa×s	507.05	Calculated Property
η	0.0005882	Pa×s	528.86	Calculated Property
η	0.0005077	Pa×s	550.68	Calculated Property
η	0.0004432	Pa×s	572.49	Calculated Property
η	0.0003908	Pa×s	594.30	Calculated Property
η	0.0003476	Pa×s	616.11	Calculated Property
η	0.0003117	Pa×s	637.92	Calculated Property
η	0.0002815	Pa×s	659.73	Calculated Property

Similar Compounds

Find more compounds similar to «beta»-(1-Naphthyl)acrylic acid.

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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