- InChI
- InChI=1S/C9H17NO/c1-4-7-9(5-2,6-3)8(10)11/h4H,1,5-7H2,2-3H3,(H2,10,11)
- InChI Key
- LOMDVEFCNVDZMZ-UHFFFAOYSA-N
- Formula
- C9H17NO
- SMILES
- C=CCC(CC)(CC)C(N)=O
- Molecular Weight1
- 155.24
- CAS
- 512-48-1
- Other Names
-
- 4-Pentenamide, 2,2-diethyl-
- Diethylallylacetamide
- Epinoval
- Novonal
- 2,2-Diethyl-4-pentenamide
- Allyldiethylacetamide
- 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° | 53.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -191.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.05 | kJ/mol | Joback Calculated Property |
| log10WS | -2.41 | Crippen Calculated Property | |
| logPoct/wat | 1.854 | Crippen Calculated Property | |
| McVol | 144.920 | ml/mol | McGowan Calculated Property |
| Pc | 2767.17 | kPa | Joback Calculated Property |
| Inp | [1285.00; 1285.00] |
|
|
| Inp | 1285.00 | NIST | |
| Inp | 1285.00 | NIST | |
| Tboil | 525.17 | K | Joback Calculated Property |
| Tc | 725.23 | K | Joback Calculated Property |
| Tfus | 325.04 | K | Joback Calculated Property |
| Vc | 0.544 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [343.62; 416.27] | J/mol×K | [525.17; 725.23] |
|
| Cp,gas | 343.62 | J/mol×K | 525.17 | Joback Calculated Property |
| Cp,gas | 357.66 | J/mol×K | 558.51 | Joback Calculated Property |
| Cp,gas | 370.87 | J/mol×K | 591.86 | Joback Calculated Property |
| Cp,gas | 383.29 | J/mol×K | 625.20 | Joback Calculated Property |
| Cp,gas | 394.97 | J/mol×K | 658.54 | Joback Calculated Property |
| Cp,gas | 405.95 | J/mol×K | 691.88 | Joback Calculated Property |
| Cp,gas | 416.27 | J/mol×K | 725.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Valdetamide.
Sources
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