Chemical Properties of Benzeneacetic acid, «alpha»-methyl-, (R)- (CAS 7782-26-5)

InChI

InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m0/s1

InChI Key

YPGCWEMNNLXISK-ZETCQYMHSA-N

Formula

C9H10O2

SMILES

CC(C(=O)O)c1ccccc1

Molecular Weight¹

150.17

CAS

7782-26-5

• ω : Acentric Factor.
• 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).
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[152.46; 376.44]	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			-3.62800e+01
Coefficient B			8.36620e-01
Coefficient C			-5.72800e-04
Coefficient D			1.48900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	152.46	J/mol×K	273.00	Calculated Property
Cp,gas	194.60	J/mol×K	353.78	Calculated Property
Cp,gas	231.33	J/mol×K	434.56	Calculated Property
Cp,gas	263.12	J/mol×K	515.33	Calculated Property
Cp,gas	290.44	J/mol×K	596.11	Calculated Property
Cp,gas	313.75	J/mol×K	676.89	Calculated Property
Cp,gas	333.54	J/mol×K	757.67	Calculated Property
Cp,gas	350.27	J/mol×K	838.44	Calculated Property
Cp,gas	364.41	J/mol×K	919.22	Calculated Property
Cp,gas	376.44	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016664; 0.0002345]	Pa×s	[363.21; 564.42]	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			-1.18982e+01
Coefficient B			1.99806e+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.			363.21
Temperature range, max.			564.42
η	0.0016664	Pa×s	363.21	Calculated Property
η	0.0012113	Pa×s	385.57	Calculated Property
η	0.0009118	Pa×s	407.92	Calculated Property
η	0.0007069	Pa×s	430.28	Calculated Property
η	0.0005621	Pa×s	452.64	Calculated Property
η	0.0004566	Pa×s	474.99	Calculated Property
η	0.0003779	Pa×s	497.35	Calculated Property
η	0.0003180	Pa×s	519.71	Calculated Property
η	0.0002713	Pa×s	542.06	Calculated Property
η	0.0002345	Pa×s	564.42	Calculated Property

Similar Compounds

Find more compounds similar to Benzeneacetic acid, «alpha»-methyl-, (R)-.

Sources

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

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