Chemical Properties of 2-Oxazolidinethione, 4,4-dimethyl- (CAS 54013-55-7)

2-Oxazolidinethione, 4,4-dimethyl-

InChI
InChI=1S/C5H9NOS/c1-5(2)3-7-4(8)6-5/h3H2,1-2H3,(H,6,8)
InChI Key
VIMMIOUDVZQBAK-UHFFFAOYSA-N
Formula
C5H9NOS
SMILES
CC1(C)COC(=S)N1
Molecular Weight1
131.20
CAS
54013-55-7
Other Names
  • 4,4-Dimethyloxazolidine-2-thione
  • Oxazolidine-2-thione, 4,4-dimethyl-
  • 4,4-Dimethyloxazoline-2-thiol
  • 4,4-Dimethyl-2-oxazolidinethione
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Physical Properties

Property Value Unit Source
ΔfusH° 19.95 kJ/mol Joback Calculated Property
IE 8.17 eV Relay (1.0) Calculated Property
logPoct/wat 0.670 Crippen Calculated Property
McVol 98.350 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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 [123.17; 310.42] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.05100e+01
Coefficient B8.96030e-01
Coefficient C-9.27500e-04
Coefficient D4.02400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 123.17 J/mol×K 273.00 Calculated Property
Cp,gas 158.22 J/mol×K 353.78 Calculated Property
Cp,gas 186.74 J/mol×K 434.56 Calculated Property
Cp,gas 210.00 J/mol×K 515.33 Calculated Property
Cp,gas 229.28 J/mol×K 596.11 Calculated Property
Cp,gas 245.84 J/mol×K 676.89 Calculated Property
Cp,gas 260.96 J/mol×K 757.67 Calculated Property
Cp,gas 275.92 J/mol×K 838.44 Calculated Property
Cp,gas 291.98 J/mol×K 919.22 Calculated Property
Cp,gas 310.42 J/mol×K 1000.00 Calculated Property

Similar Compounds

4,4-DIMETHYL-2-OXAZOLIDINONE. 2-Ethylamino-2-methylpropane-1,3-diol, diethyl ether. 2-[Methyl(amino)]-2-(methyloxymethyl)propane-1,3-diol, dimethyl ether. 2-Oxazolidinone,4-methyl-. 2-Acetamido-2-([(trimethylsilyl)oxy]methyl)propane-1,3-diyl diacetate. D-Alanine, N-neopentyloxycarbonyl-, neopentyl ester. 2-Diethylamino-2-methylpropane-1,3-diol, diethyl ether. Alanine, 2-methyl-N-(trifluoroacetyl)-, butyl ester. D-Alanine, N-neopentyloxycarbonyl-, isobutyl ester. «alpha»-Aminoisobutyric acid, N-isoBOC TBDMS. 2-Methylamino-2-methylpropan-1-ol, N-pentafluoropropionyl, methyl ether. N-Phenethyl O-propyl thiocarbamate. N-Ethyl O-propyl thiocarbamate. 2-(Dimethyl)amino-2-methylpropane-1,3-diol, dimethyl ether. Carbamic acid, (1-methylethyl)-, 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl ester.

Find more compounds similar to 2-Oxazolidinethione, 4,4-dimethyl-.

Sources

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