Chemical Properties of Oxazole, 4,5-dihydro-2,4,4-trimethyl-

InChI

InChI=1S/C6H11NO/c1-5-7-6(2,3)4-8-5/h4H2,1-3H3

InChI Key

HZRZMHNRCSIQFT-UHFFFAOYSA-N

Formula

C6H11NO

SMILES

CC1=NC(C)(C)CO1

Molecular Weight¹

113.16

Other Names

• 2,4,4-Trimethyl-2-oxazoline
• 2-Oxazoline, 2,4,4-trimethyl-
• 2,4,4-Trimethyl-1,3-oxazoline
• 4,5-Dihydro-2,4,4-trimethyloxazole
• 2,4,4-Trimethyl-delta^2-oxazoline

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[129.47; 359.32]	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			-6.67200e+01
Coefficient B			9.12440e-01
Coefficient C			-7.93700e-04
Coefficient D			3.07300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	129.47	J/mol×K	273.00	Calculated Property
Cp,gas	170.35	J/mol×K	353.78	Calculated Property
Cp,gas	205.12	J/mol×K	434.56	Calculated Property
Cp,gas	234.77	J/mol×K	515.33	Calculated Property
Cp,gas	260.25	J/mol×K	596.11	Calculated Property
Cp,gas	282.55	J/mol×K	676.89	Calculated Property
Cp,gas	302.63	J/mol×K	757.67	Calculated Property
Cp,gas	321.48	J/mol×K	838.44	Calculated Property
Cp,gas	340.05	J/mol×K	919.22	Calculated Property
Cp,gas	359.32	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Oxazole, 4,5-dihydro-2,4,4-trimethyl-.

Sources

• 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.
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