- InChI
- InChI=1S/C7H14Cl2S2/c8-2-6-10-4-1-5-11-7-3-9/h1-7H2
- InChI Key
- YHRGRBPJIRKFND-UHFFFAOYSA-N
- Formula
- C7H14Cl2S2
- SMILES
- ClCCSCCCSCCCl
- Molecular Weight1
- 233.22
- CAS
- 63905-10-2
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 50.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -135.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.58 | kJ/mol | Joback Calculated Property |
| log10WS | -2.83 | Crippen Calculated Property | |
| logPoct/wat | 3.321 | Crippen Calculated Property | |
| McVol | 166.670 | ml/mol | McGowan Calculated Property |
| Pc | 2684.64 | kPa | Joback Calculated Property |
| Inp | [1811.00; 1811.00] |
|
|
| Inp | 1811.00 | NIST | |
| Inp | 1811.00 | NIST | |
| Inp | 1811.00 | NIST | |
| Tboil | 571.98 | K | Joback Calculated Property |
| Tc | 790.53 | K | Joback Calculated Property |
| Tfus | 297.29 | K | Joback Calculated Property |
| Vc | 0.633 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.10; 410.98] | J/mol×K | [571.98; 790.53] |
|
| Cp,gas | 348.10 | J/mol×K | 571.98 | Joback Calculated Property |
| Cp,gas | 360.23 | J/mol×K | 608.41 | Joback Calculated Property |
| Cp,gas | 371.69 | J/mol×K | 644.83 | Joback Calculated Property |
| Cp,gas | 382.48 | J/mol×K | 681.26 | Joback Calculated Property |
| Cp,gas | 392.62 | J/mol×K | 717.68 | Joback Calculated Property |
| Cp,gas | 402.12 | J/mol×K | 754.11 | Joback Calculated Property |
| Cp,gas | 410.98 | J/mol×K | 790.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Bis(2-chloroethylthio)propane.
Sources
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