- InChI
- InChI=1S/C8H17NS3/c1-4-9(5-2)7-8-11-12-10-6-3/h6H,3-5,7-8H2,1-2H3
- InChI Key
- AAPQWDNLEVLBGA-UHFFFAOYSA-N
- Formula
- C8H17NS3
- SMILES
- C=CSSSCCN(CC)CC
- Molecular Weight1
- 223.42
- 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° | 314.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 110.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.23 | kJ/mol | Joback Calculated Property |
| log10WS | -3.72 | Crippen Calculated Property | |
| logPoct/wat | 3.501 | Crippen Calculated Property | |
| McVol | 178.310 | ml/mol | McGowan Calculated Property |
| Pc | 2784.72 | kPa | Joback Calculated Property |
| Inp | [1570.00; 1576.00] |
|
|
| Inp | 1576.00 | NIST | |
| Inp | 1576.00 | NIST | |
| Inp | 1570.00 | NIST | |
| Inp | 1576.00 | NIST | |
| Inp | 1570.00 | NIST | |
| Tboil | 597.90 | K | Joback Calculated Property |
| Tc | 823.94 | K | Joback Calculated Property |
| Tfus | 313.83 | K | Joback Calculated Property |
| Vc | 0.644 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [409.07; 483.75] | J/mol×K | [597.90; 823.94] |
|
| Cp,gas | 409.07 | J/mol×K | 597.90 | Joback Calculated Property |
| Cp,gas | 423.72 | J/mol×K | 635.57 | Joback Calculated Property |
| Cp,gas | 437.47 | J/mol×K | 673.25 | Joback Calculated Property |
| Cp,gas | 450.33 | J/mol×K | 710.92 | Joback Calculated Property |
| Cp,gas | 462.32 | J/mol×K | 748.59 | Joback Calculated Property |
| Cp,gas | 473.45 | J/mol×K | 786.26 | Joback Calculated Property |
| Cp,gas | 483.75 | J/mol×K | 823.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Diethylaminoethyl vinyl trisulfide.
Sources
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