- InChI
- InChI=1S/C7H15NOS/c1-4-8(5-2)7(9)10-6-3/h4-6H2,1-3H3
- InChI Key
- WARIWGPBHKPYON-UHFFFAOYSA-N
- Formula
- C7H15NOS
- SMILES
- CCSC(=O)N(CC)CC
- Molecular Weight1
- 161.26
- CAS
- 2941-55-1
- Other Names
-
- Carbamothioic acid, diethyl-, S-ethyl ester
- Carbamic acid, diethylthio-, S-ethyl ester
- S-Ethyl N,N-diethylthiocarbamate
- S-Ethyl diethylcarbamothioate
- S-Ethyl diethylthiocarbamate
- S-15076
- Etirox
- 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).
- 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° | 23.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -190.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.78 | kJ/mol | Joback Calculated Property |
| log10WS | -1.96 | Crippen Calculated Property | |
| logPoct/wat | 2.201 | Crippen Calculated Property | |
| McVol | 137.390 | ml/mol | McGowan Calculated Property |
| Pc | 3045.68 | kPa | Joback Calculated Property |
| Tboil | 494.65 | K | Joback Calculated Property |
| Tc | 690.36 | K | Joback Calculated Property |
| Tfus | 285.45 | K | Joback Calculated Property |
| Vc | 0.505 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [296.64; 365.11] | J/mol×K | [494.65; 690.36] | 
|
| Cp,gas | 296.64 | J/mol×K | 494.65 | Joback Calculated Property |
| Cp,gas | 309.57 | J/mol×K | 527.27 | Joback Calculated Property |
| Cp,gas | 321.88 | J/mol×K | 559.89 | Joback Calculated Property |
| Cp,gas | 333.57 | J/mol×K | 592.51 | Joback Calculated Property |
| Cp,gas | 344.66 | J/mol×K | 625.13 | Joback Calculated Property |
| Cp,gas | 355.17 | J/mol×K | 657.74 | Joback Calculated Property |
| Cp,gas | 365.11 | J/mol×K | 690.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethiolate.
Sources
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