- InChI
- InChI=1S/C14H16N2OS2/c1-3-16(4-2)11-7-5-10(6-8-11)9-12-13(17)15-14(18)19-12/h5-9H,3-4H2,1-2H3,(H,15,17,18)/b12-9+
- InChI Key
- CWQLQYNQWCTDQF-FMIVXFBMSA-N
- Formula
- C14H16N2OS2
- SMILES
-
CCN(CC)c1ccc(C=C2SC(=S)NC2=O)c
c1 - Molecular Weight1
- 292.42
- CAS
- 35778-58-6
- Other Names
-
- p-Diethylaminobenzylidene rhodanine
- 4-Thiazolidinone, 5-[[4-(diethylamino)phenyl]methylene]-2-thioxo-
- 5-(p-(Diethylamino)benzylidene)rhodanine
- 5-[p-(diethylamino)benzylidene]-2-thioxothiazolidin-4-one
- 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° | 466.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 177.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.39 | kJ/mol | Joback Calculated Property |
| log10WS | -4.46 | Crippen Calculated Property | |
| logPoct/wat | 3.022 | Crippen Calculated Property | |
| McVol | 219.130 | ml/mol | McGowan Calculated Property |
| Pc | 2805.41 | kPa | Joback Calculated Property |
| Tboil | 827.25 | K | Joback Calculated Property |
| Tc | 1090.66 | K | Joback Calculated Property |
| Tfus | 664.82 | K | Joback Calculated Property |
| Vc | 0.782 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [599.29; 669.63] | J/mol×K | [827.25; 1090.66] | 
|
| Cp,gas | 599.29 | J/mol×K | 827.25 | Joback Calculated Property |
| Cp,gas | 613.55 | J/mol×K | 871.15 | Joback Calculated Property |
| Cp,gas | 626.67 | J/mol×K | 915.05 | Joback Calculated Property |
| Cp,gas | 638.75 | J/mol×K | 958.96 | Joback Calculated Property |
| Cp,gas | 649.87 | J/mol×K | 1002.86 | Joback Calculated Property |
| Cp,gas | 660.13 | J/mol×K | 1046.76 | Joback Calculated Property |
| Cp,gas | 669.63 | J/mol×K | 1090.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-(4-Diethylaminobenzylidene)rhodanine.
Sources
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