- InChI
- InChI=1S/C5H10S2/c1-3-4-7-5-6-2/h3H,1,4-5H2,2H3
- InChI Key
- AZMAQKWZXGXASG-UHFFFAOYSA-N
- Formula
- C5H10S2
- SMILES
- C=CCSCSC
- Molecular Weight1
- 134.26
- 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° | 145.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 62.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.69 | kJ/mol | Joback Calculated Property |
| log10WS | -2.03 | Crippen Calculated Property | |
| logPoct/wat | 2.226 | Crippen Calculated Property | |
| McVol | 109.710 | ml/mol | McGowan Calculated Property |
| Pc | 3801.00 | kPa | Joback Calculated Property |
| Inp | [1052.00; 1052.00] |
|
|
| Inp | 1052.00 | NIST | |
| Inp | 1052.00 | NIST | |
| Tboil | 448.04 | K | Joback Calculated Property |
| Tc | 668.29 | K | Joback Calculated Property |
| Tfus | 213.15 | K | Joback Calculated Property |
| Vc | 0.405 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [197.76; 251.64] | J/mol×K | [448.04; 668.29] |
|
| Cp,gas | 197.76 | J/mol×K | 448.04 | Joback Calculated Property |
| Cp,gas | 207.91 | J/mol×K | 484.75 | Joback Calculated Property |
| Cp,gas | 217.59 | J/mol×K | 521.46 | Joback Calculated Property |
| Cp,gas | 226.80 | J/mol×K | 558.17 | Joback Calculated Property |
| Cp,gas | 235.54 | J/mol×K | 594.88 | Joback Calculated Property |
| Cp,gas | 243.82 | J/mol×K | 631.59 | Joback Calculated Property |
| Cp,gas | 251.64 | J/mol×K | 668.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,6-dithia-1-heptene.
Sources
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