Chemical Properties of Carbonic acid, allyl 3-methylphenyl ester

InChI

InChI=1S/C11H12O3/c1-3-7-13-11(12)14-10-6-4-5-9(2)8-10/h3-6,8H,1,7H2,2H3

InChI Key

CLOWDQOEQBVSPC-UHFFFAOYSA-N

Formula

C11H12O3

SMILES

C=CCOC(=O)Oc1cccc(C)c1

Molecular Weight¹

192.21

• 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).
• 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_np : Non-polar retention indices.
• 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, Enthalpy of formation at standard conditions, 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	[206.06; 463.36]	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			2.12010e+01
Coefficient B			7.72420e-01
Coefficient C			-3.56060e-04
Coefficient D			2.58000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	206.06	J/mol×K	273.00	Calculated Property
Cp,gas	251.04	J/mol×K	353.78	Calculated Property
Cp,gas	291.74	J/mol×K	434.56	Calculated Property
Cp,gas	328.23	J/mol×K	515.33	Calculated Property
Cp,gas	360.59	J/mol×K	596.11	Calculated Property
Cp,gas	388.91	J/mol×K	676.89	Calculated Property
Cp,gas	413.26	J/mol×K	757.67	Calculated Property
Cp,gas	433.73	J/mol×K	838.44	Calculated Property
Cp,gas	450.41	J/mol×K	919.22	Calculated Property
Cp,gas	463.36	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0017435; 0.0001689]	Pa×s	[315.47; 539.15]	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			-1.19784e+01
Coefficient B			1.77501e+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.			315.47
Temperature range, max.			539.15
η	0.0017435	Pa×s	315.47	Calculated Property
η	0.0011561	Pa×s	340.32	Calculated Property
η	0.0008106	Pa×s	365.18	Calculated Property
η	0.0005947	Pa×s	390.03	Calculated Property
η	0.0004528	Pa×s	414.88	Calculated Property
η	0.0003555	Pa×s	439.74	Calculated Property
η	0.0002865	Pa×s	464.59	Calculated Property
η	0.0002360	Pa×s	489.44	Calculated Property
η	0.0001980	Pa×s	514.30	Calculated Property
η	0.0001689	Pa×s	539.15	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, allyl 3-methylphenyl 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.