Chemical Properties of 2-Phenoxy-3-methyl-2-butene (CAS 42237-97-8)

InChI

InChI=1S/C11H14O/c1-9(2)10(3)12-11-7-5-4-6-8-11/h4-8H,1-3H3

InChI Key

DYDDSAIUFYQRNP-UHFFFAOYSA-N

Formula

C11H14O

SMILES

CC(C)=C(C)Oc1ccccc1

Molecular Weight¹

162.23

CAS

42237-97-8

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_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 Volume, Standard Gibbs free energy of formation 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	[183.28; 455.68]	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			-2.90800e+01
Coefficient B			9.26560e-01
Coefficient C			-5.83200e-04
Coefficient D			1.41400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	183.28	J/mol×K	273.00	Calculated Property
Cp,gas	231.98	J/mol×K	353.78	Calculated Property
Cp,gas	275.03	J/mol×K	434.56	Calculated Property
Cp,gas	312.88	J/mol×K	515.33	Calculated Property
Cp,gas	345.97	J/mol×K	596.11	Calculated Property
Cp,gas	374.74	J/mol×K	676.89	Calculated Property
Cp,gas	399.65	J/mol×K	757.67	Calculated Property
Cp,gas	421.15	J/mol×K	838.44	Calculated Property
Cp,gas	439.68	J/mol×K	919.22	Calculated Property
Cp,gas	455.68	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-Phenoxy-3-methyl-2-butene.

Sources

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

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