- InChI
- InChI=1S/C9H20S3/c1-4-7-10-9(6-3)12-11-8-5-2/h9H,4-8H2,1-3H3
- InChI Key
- NPIXBDUKSDQMKL-UHFFFAOYSA-N
- Formula
- C9H20S3
- SMILES
- CCCSSC(CC)SCCC
- Molecular Weight1
- 224.45
- Other Names
-
- 6-Ethyl-4,5,7-trithiadecane
- 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 | 0.4055 | Relay (1.0) Calculated Property | |
| ΔfG° | 121.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -138.78 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.79 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.11 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.657 | Crippen Calculated Property | |
| McVol | 186.720 | ml/mol | McGowan Calculated Property |
| Pc | 2443.48 | kPa | Joback Calculated Property |
| Inp | [1535.90; 1557.00] |
|
|
| Inp | 1535.90 | NIST | |
| Inp | 1557.00 | NIST | |
| Inp | 1557.00 | NIST | |
| Inp | 1535.90 | NIST | |
| Tboil | 548.90 | K | Relay (1.0) Calculated Property |
| Tc | 734.86 | K | Relay (1.0) Calculated Property |
| Tfus | 197.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.645 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.82; 524.73] | J/mol×K | [611.22; 836.59] |
|
| Cp,gas | 442.82 | J/mol×K | 611.22 | Joback Calculated Property |
| Cp,gas | 458.74 | J/mol×K | 648.78 | Joback Calculated Property |
| Cp,gas | 473.75 | J/mol×K | 686.34 | Joback Calculated Property |
| Cp,gas | 487.85 | J/mol×K | 723.91 | Joback Calculated Property |
| Cp,gas | 501.05 | J/mol×K | 761.47 | Joback Calculated Property |
| Cp,gas | 513.34 | J/mol×K | 799.03 | Joback Calculated Property |
| Cp,gas | 524.73 | J/mol×K | 836.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-(propylthio)propyl propyl disulfide.
Sources
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