- InChI
- InChI=1S/C12H24O8S2/c13-21(14)9-5-17-1-2-18-6-10-22(15,16)12-8-20-4-3-19-7-11-21/h1-12H2
- InChI Key
- YTAKFJGXYLYLKU-UHFFFAOYSA-N
- Formula
- C12H24O8S2
- SMILES
-
O=S1(=O)CCOCCOCCS(=O)(=O)CCOCC
OCC1 - Molecular Weight1
- 360.45
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6300 | Relay (1.0) Calculated Property | |
| ΔfG° | -1330.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1389.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 159.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.30 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | -1.104 | Crippen Calculated Property | |
| McVol | 248.740 | ml/mol | McGowan Calculated Property |
| Pc | 3886.79 | kPa | Joback Calculated Property |
| Tboil | 783.19 | K | Relay (1.0) Calculated Property |
| Tc | 1026.07 | K | Relay (1.0) Calculated Property |
| Tfus | 403.62 | K | Relay (1.0) Calculated Property |
| Vc | 0.791 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [733.51; 843.98] | J/mol×K | [711.08; 950.64] | 
|
| Cp,gas | 733.51 | J/mol×K | 711.08 | Joback Calculated Property |
| Cp,gas | 758.38 | J/mol×K | 751.01 | Joback Calculated Property |
| Cp,gas | 780.81 | J/mol×K | 790.93 | Joback Calculated Property |
| Cp,gas | 800.69 | J/mol×K | 830.86 | Joback Calculated Property |
| Cp,gas | 817.91 | J/mol×K | 870.78 | Joback Calculated Property |
| Cp,gas | 832.38 | J/mol×K | 910.71 | Joback Calculated Property |
| Cp,gas | 843.98 | J/mol×K | 950.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,7,13,16-Tetraoxa-1,10-dithiacyclooctadecane-1,1,10,10-tetraoxide.
Sources
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