Chemical Properties of P-isopropylphenyl allyl ether (CAS 71029-37-3)

InChI

InChI=1S/C12H16O/c1-4-9-13-12-7-5-11(6-8-12)10(2)3/h4-8,10H,1,9H2,2-3H3

InChI Key

QVGYGYMFMUBSHD-UHFFFAOYSA-N

Formula

C12H16O

SMILES

C=CCOc1ccc(C(C)C)cc1

Molecular Weight¹

176.25

CAS

71029-37-3

• 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).
• 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_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

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[210.62; 507.38]	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			-6.79900e+00
Coefficient B			9.28140e-01
Coefficient C			-5.08260e-04
Coefficient D			9.43000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	210.62	J/mol×K	273.00	Calculated Property
Cp,gas	262.12	J/mol×K	353.78	Calculated Property
Cp,gas	308.29	J/mol×K	434.56	Calculated Property
Cp,gas	349.43	J/mol×K	515.33	Calculated Property
Cp,gas	385.84	J/mol×K	596.11	Calculated Property
Cp,gas	417.82	J/mol×K	676.89	Calculated Property
Cp,gas	445.67	J/mol×K	757.67	Calculated Property
Cp,gas	469.68	J/mol×K	838.44	Calculated Property
Cp,gas	490.15	J/mol×K	919.22	Calculated Property
Cp,gas	507.38	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0024807; 0.0001717]	Pa×s	[269.41; 512.35]	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			-1.16310e+01
Coefficient B			1.51727e+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.			269.41
Temperature range, max.			512.35
η	0.0024807	Pa×s	269.41	Calculated Property
η	0.0014853	Pa×s	296.40	Calculated Property
η	0.0009689	Pa×s	323.40	Calculated Property
η	0.0006750	Pa×s	350.39	Calculated Property
η	0.0004952	Pa×s	377.38	Calculated Property
η	0.0003786	Pa×s	404.38	Calculated Property
η	0.0002994	Pa×s	431.37	Calculated Property
η	0.0002434	Pa×s	458.36	Calculated Property
η	0.0002025	Pa×s	485.36	Calculated Property
η	0.0001717	Pa×s	512.35	Calculated Property

Similar Compounds

Find more compounds similar to P-isopropylphenyl allyl ether.

Sources

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

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