Chemical Properties of 4-Acetoxy-3-methoxystyrene (CAS 46316-15-8)

InChI

InChI=1S/C11H12O3/c1-4-9-5-6-10(14-8(2)12)11(7-9)13-3/h4-7H,1H2,2-3H3

InChI Key

FTBUUBIPWKNBRF-UHFFFAOYSA-N

Formula

C11H12O3

SMILES

C=Cc1ccc(OC(C)=O)c(OC)c1

Molecular Weight¹

192.21

CAS

46316-15-8

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• I_p : Polar retention indices.
• 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 formation 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	[208.61; 460.32]	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			3.55000e+01
Coefficient B			7.12940e-01
Coefficient C			-2.89020e-04
Coefficient D			9.00000e-10
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	208.61	J/mol×K	273.00	Calculated Property
Cp,gas	251.59	J/mol×K	353.78	Calculated Property
Cp,gas	290.81	J/mol×K	434.56	Calculated Property
Cp,gas	326.27	J/mol×K	515.33	Calculated Property
Cp,gas	357.98	J/mol×K	596.11	Calculated Property
Cp,gas	385.94	J/mol×K	676.89	Calculated Property
Cp,gas	410.15	J/mol×K	757.67	Calculated Property
Cp,gas	430.61	J/mol×K	838.44	Calculated Property
Cp,gas	447.34	J/mol×K	919.22	Calculated Property
Cp,gas	460.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013216; 0.0001646]	Pa×s	[327.99; 543.36]	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			-1.18844e+01
Coefficient B			1.72375e+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.			327.99
Temperature range, max.			543.36
η	0.0013216	Pa×s	327.99	Calculated Property
η	0.0009245	Pa×s	351.92	Calculated Property
η	0.0006768	Pa×s	375.85	Calculated Property
η	0.0005143	Pa×s	399.78	Calculated Property
η	0.0004032	Pa×s	423.71	Calculated Property
η	0.0003244	Pa×s	447.64	Calculated Property
η	0.0002668	Pa×s	471.57	Calculated Property
η	0.0002236	Pa×s	495.50	Calculated Property
η	0.0001905	Pa×s	519.43	Calculated Property
η	0.0001646	Pa×s	543.36	Calculated Property

Similar Compounds

Find more compounds similar to 4-Acetoxy-3-methoxystyrene.

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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