Chemical Properties of 1,3-Oxathiane, 2,4,6-trimethyl-, (2«alpha»,4«alpha»,6«beta»)- (CAS 22425-91-8)

1,3-Oxathiane, 2,4,6-trimethyl-, (2«alpha»,4«alpha»,6«beta»)-

InChI
InChI=1S/C7H14OS/c1-5-4-6(2)9-7(3)8-5/h5-7H,4H2,1-3H3/t5-,6-,7+/m0/s1
InChI Key
DUDZTWRICXYHEJ-LYFYHCNISA-N
Formula
C7H14OS
SMILES
CC1CC(C)SC(C)O1
Molecular Weight1
146.25
CAS
22425-91-8
Other Names
  • 1,3-Oxathiane, 2,4,6-trimethyl-, cis-2,4,trans-2,6-
  • 2,4,6-Trimethyl-1,3-oxathiane, cis-2,4,trans-2,6-
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Physical Properties

Property Value Unit Source
ΔfH°gas -259.75 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 19.50 kJ/mol Joback Calculated Property
ΔvapH° 50.68 kJ/mol Relay (1.0) Calculated Property
IE 8.54 eV NIST
logPoct/wat 2.263 Crippen Calculated Property
McVol 120.850 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [251.69; 340.09] J/mol×K [444.55; 662.56] Show Hide
Cp,gas 251.69 J/mol×K 444.55 Joback Calculated Property
Cp,gas 268.35 J/mol×K 480.88 Joback Calculated Property
Cp,gas 284.23 J/mol×K 517.22 Joback Calculated Property
Cp,gas 299.33 J/mol×K 553.55 Joback Calculated Property
Cp,gas 313.67 J/mol×K 589.89 Joback Calculated Property
Cp,gas 327.26 J/mol×K 626.22 Joback Calculated Property
Cp,gas 340.09 J/mol×K 662.56 Joback Calculated Property

Similar Compounds

1,3-Oxathiane, 2,4,6-trimethyl-, (2«alpha»,4«beta»,6«alpha»)-. 1,3-Oxathiane, 2,4,6-trimethyl-, (2«alpha»,4«alpha»,6«alpha»)-. 1,3-Oxathiane, 2,2,4,6-tetramethyl-, cis-. 1,3-Oxathiane,2,2,4,6-tetramethyl,trans-. 1,3-Oxathiane, 4,6-dimethyl-, cis-. 1,3-Oxathiane, 4,6-dimethyl-, trans-. trans-2-methyl-4- n-propyl-1,3-oxathiane. cis-2-methyl-4- n-propyl-1,3-oxathiane. 1,3-dimethylbicyclo[3.3.0]-2,8-dioxa-4-thiaoctane. Anti-2-cis-4,5-trimethyl-1,3-oxathiolane. 2-hydroxy-2-methylpropyl glucosinolate, TMS. 5-«beta»-Pregnan-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS, # 2. Pregnan-2,3,20-triol, GlcNAc, MeTMS. 5-«alpha»-Pregnan-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS, # 2. 5-«beta»-Pregnan-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS, # 1.

Find more compounds similar to 1,3-Oxathiane, 2,4,6-trimethyl-, (2«alpha»,4«alpha»,6«beta»)-.

Sources

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