- InChI
- InChI=1S/C9H16S4/c1-4-6-10-8-9(3)12-13-11-7-5-2/h4-5,9H,1-2,6-8H2,3H3
- InChI Key
- ZYOACKSTGJDIHX-UHFFFAOYSA-N
- Formula
- C9H16S4
- SMILES
- C=CCSCC(C)SSSCC=C
- Molecular Weight1
- 252.48
- 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).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- 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 | 0.3251 | Relay (... Calculated Property | |
| ΔfG° | 330.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 44.72 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 29.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.05 | kJ/mol | Relay (... Calculated Property |
| IE | 8.10 | eV | Relay (... Calculated Property |
| log10WS | -3.89 | Relay (... Calculated Property | |
| logPoct/wat | 4.510 | Crippen Calculated Property | |
| McVol | 194.470 | ml/mol | McGowan Calculated Property |
| Pc | 2707.03 | kPa | Joback Calculated Property |
| Inp | 1819.00 | NIST | |
| Tboil | 601.34 | K | Relay (... Calculated Property |
| Tc | 789.83 | K | Relay (... Calculated Property |
| Tfus | 231.22 | K | Relay (... Calculated Property |
| Vc | 0.608 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [451.20; 520.52] | J/mol×K | [673.36; 925.93] | 
|
| Cp,gas | 451.20 | J/mol×K | 673.36 | Joback Calculated Property |
| Cp,gas | 465.49 | J/mol×K | 715.45 | Joback Calculated Property |
| Cp,gas | 478.66 | J/mol×K | 757.55 | Joback Calculated Property |
| Cp,gas | 490.75 | J/mol×K | 799.64 | Joback Calculated Property |
| Cp,gas | 501.74 | J/mol×K | 841.74 | Joback Calculated Property |
| Cp,gas | 511.66 | J/mol×K | 883.83 | Joback Calculated Property |
| Cp,gas | 520.52 | J/mol×K | 925.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-methyl-4,5,6,9-tetrathia-1,11-dodecadiene.
Sources
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