- InChI
- InChI=1S/C9H19NS2/c1-6-12-9(11)10(7(2)3)8(4)5/h7-8H,6H2,1-5H3
- InChI Key
- GYWHIYKCCVKRAS-UHFFFAOYSA-N
- Formula
- C9H19NS2
- SMILES
- CCSC(=S)N(C(C)C)C(C)C
- Molecular Weight1
- 205.38
- 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 | 0.3706 | Relay (1.0) Calculated Property | |
| ΔfG° | 280.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -75.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.14 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.143 | Crippen Calculated Property | |
| McVol | 176.050 | ml/mol | McGowan Calculated Property |
| Pc | 2605.74 | kPa | Joback Calculated Property |
| Inp | 1540.00 | NIST | |
| Tboil | 513.12 | K | Relay (1.0) Calculated Property |
| Tc | 701.46 | K | Relay (1.0) Calculated Property |
| Tfus | 281.09 | K | Relay (1.0) Calculated Property |
| Vc | 0.589 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [404.71; 484.96] | J/mol×K | [555.70; 769.66] | 
|
| Cp,gas | 404.71 | J/mol×K | 555.70 | Joback Calculated Property |
| Cp,gas | 420.31 | J/mol×K | 591.36 | Joback Calculated Property |
| Cp,gas | 434.95 | J/mol×K | 627.02 | Joback Calculated Property |
| Cp,gas | 448.68 | J/mol×K | 662.68 | Joback Calculated Property |
| Cp,gas | 461.55 | J/mol×K | 698.34 | Joback Calculated Property |
| Cp,gas | 473.62 | J/mol×K | 734.00 | Joback Calculated Property |
| Cp,gas | 484.96 | J/mol×K | 769.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to S-Ethyl-N,N-diisopropyldithiocarbamate.
Sources
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