Chemical Properties of bis(1-methyl-2-oxobutyl) sulfide

bis(1-methyl-2-oxobutyl) sulfide

InChI
InChI=1S/C10H18O2S/c1-5-9(11)7(3)13-8(4)10(12)6-2/h7-8H,5-6H2,1-4H3
InChI Key
STEMUDBXFWZOOG-UHFFFAOYSA-N
Formula
C10H18O2S
SMILES
CCC(=O)C(C)SC(C)C(=O)CC
Molecular Weight1
202.32
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Physical Properties

Property Value Unit Source
ΔfH°gas -495.20 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 21.94 kJ/mol Joback Calculated Property
ΔvapH° 64.06 kJ/mol Relay (1.0) Calculated Property
IE 8.22 eV Relay (1.0) Calculated Property
logPoct/wat 2.455 Crippen Calculated Property
McVol 171.250 ml/mol McGowan Calculated Property
Inp [1460.00; 1460.00]   Show Hide
Inp 1460.00 NIST
Inp 1460.00 NIST
Tboil 505.70 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [420.49; 495.11] J/mol×K [604.04; 810.58] Show Hide
Cp,gas 420.49 J/mol×K 604.04 Joback Calculated Property
Cp,gas 434.85 J/mol×K 638.46 Joback Calculated Property
Cp,gas 448.41 J/mol×K 672.89 Joback Calculated Property
Cp,gas 461.21 J/mol×K 707.31 Joback Calculated Property
Cp,gas 473.25 J/mol×K 741.73 Joback Calculated Property
Cp,gas 484.54 J/mol×K 776.16 Joback Calculated Property
Cp,gas 495.11 J/mol×K 810.58 Joback Calculated Property

Similar Compounds

2-[(1-methyl-2-oxopropyl)-thio]-3-pentanone. bis(1-methyl-2-oxopropyl) sulfide. 2-METHYLTETRAHYDROTHIOPHEN-3-ONE. 4,5-dihydro-2,5-dimethylthiophen-3(2H)-one, A. 4,5-dihydro-2,5-dimethylthiophen-3(2H)-one, B. 2-ethyl-5-methyl-4,5-dihydrothiophen-3(2H)-one. 2H-Thiopyran-3(4H)-one, dihydro-6-methyl-. 3(2H)-Thiophenone, 2-ethyldihydro-. Thiophen3(2H)-one, 4,5-dihydro-2,4-dimethyl, #2 (E or Z). 4,5-dihydro-2,(4 or 5)-dimethyl-3(2H)- thiophenone. Thiophen-3(2H)-one, 4,5-dihydro-2,4-dimethyl, # 1 (E or Z). 4,5-Dihydro-2,4-dimethyl-3(2H)-thiophenone. trans-2,6-dimethyl-thiacyclohexane. cis-2,6-dimethyl-thiacyclohexane. 2,6-Dimethylthiane.

Find more compounds similar to bis(1-methyl-2-oxobutyl) sulfide.

Sources

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