Chemical Properties of Oxetane, 3-methylene

InChI

InChI=1S/C4H6O/c1-4-2-5-3-4/h1-3H2

InChI Key

FONJUXZYNZCFSE-UHFFFAOYSA-N

Formula

C4H6O

SMILES

C=C1COC1

Molecular Weight¹

70.09

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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_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, 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	[73.60; 188.16]	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			-2.24400e+01
Coefficient B			4.31100e-01
Coefficient C			-3.16700e-04
Coefficient D			9.62000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	73.60	J/mol×K	273.00	Calculated Property
Cp,gas	94.70	J/mol×K	353.78	Calculated Property
Cp,gas	112.99	J/mol×K	434.56	Calculated Property
Cp,gas	128.78	J/mol×K	515.33	Calculated Property
Cp,gas	142.38	J/mol×K	596.11	Calculated Property
Cp,gas	154.10	J/mol×K	676.89	Calculated Property
Cp,gas	164.23	J/mol×K	757.67	Calculated Property
Cp,gas	173.08	J/mol×K	838.44	Calculated Property
Cp,gas	180.95	J/mol×K	919.22	Calculated Property
Cp,gas	188.16	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015331; 0.0002735]	Pa×s	[193.75; 367.34]	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			-1.01282e+01
Coefficient B			7.06750e+02
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.			193.75
Temperature range, max.			367.34
η	0.0015331	Pa×s	193.75	Calculated Property
η	0.0011019	Pa×s	213.04	Calculated Property
η	0.0008366	Pa×s	232.33	Calculated Property
η	0.0006626	Pa×s	251.61	Calculated Property
η	0.0005425	Pa×s	270.90	Calculated Property
η	0.0004561	Pa×s	290.19	Calculated Property
η	0.0003919	Pa×s	309.48	Calculated Property
η	0.0003428	Pa×s	328.76	Calculated Property
η	0.0003043	Pa×s	348.05	Calculated Property
η	0.0002735	Pa×s	367.34	Calculated Property

Similar Compounds

Find more compounds similar to Oxetane, 3-methylene.

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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