- InChI
- InChI=1S/C8H9NS/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)
- InChI Key
- MWCGLTCRJJFXKR-UHFFFAOYSA-N
- Formula
- C8H9NS
- SMILES
- CC(=S)Nc1ccccc1
- Molecular Weight1
- 151.23
- CAS
- 637-53-6
- Other Names
-
- Acetanilide, thio-
- N-Phenylthioacetamide
- Thioacetanilide
- USAF ek-1902
- 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).
- 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 | 0.4129 | Relay (1.0) Calculated Property | |
| ΔfG° | 335.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 117.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.20 | eV | NIST |
| log10WS | -2.74 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.446 | Crippen Calculated Property | |
| McVol | 121.850 | ml/mol | McGowan Calculated Property |
| Pc | 4162.33 | kPa | Joback Calculated Property |
| Tboil | 535.98 | K | Relay (1.0) Calculated Property |
| Tc | 811.37 | K | Relay (1.0) Calculated Property |
| Tfus | 336.91 | K | Relay (1.0) Calculated Property |
| Vc | 0.411 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [249.37; 308.55] | J/mol×K | [529.33; 770.26] | 
|
| Cp,gas | 249.37 | J/mol×K | 529.33 | Joback Calculated Property |
| Cp,gas | 261.48 | J/mol×K | 569.49 | Joback Calculated Property |
| Cp,gas | 272.58 | J/mol×K | 609.64 | Joback Calculated Property |
| Cp,gas | 282.75 | J/mol×K | 649.80 | Joback Calculated Property |
| Cp,gas | 292.07 | J/mol×K | 689.95 | Joback Calculated Property |
| Cp,gas | 300.64 | J/mol×K | 730.11 | Joback Calculated Property |
| Cp,gas | 308.55 | J/mol×K | 770.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethanethioamide, N-phenyl-.
Sources
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