- InChI
- InChI=1S/C13H23Cl2NO2/c1-2-11-16(12(17)7-3-5-9-14)13(18)8-4-6-10-15/h2-11H2,1H3
- InChI Key
- JSWOESKKUPNKHZ-UHFFFAOYSA-N
- Formula
- C13H23Cl2NO2
- SMILES
- CCCN(C(=O)CCCCCl)C(=O)CCCCCl
- Molecular Weight1
- 296.23
- 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° | -112.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -500.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.84 | kJ/mol | Joback Calculated Property |
| log10WS | -3.69 | Crippen Calculated Property | |
| logPoct/wat | 3.570 | Crippen Calculated Property | |
| McVol | 231.630 | ml/mol | McGowan Calculated Property |
| Pc | 1713.19 | kPa | Joback Calculated Property |
| Inp | [2169.00; 2169.00] |
|
|
| Inp | 2169.00 | NIST | |
| Inp | 2169.00 | NIST | |
| Tboil | 691.88 | K | Joback Calculated Property |
| Tc | 876.45 | K | Joback Calculated Property |
| Tfus | 428.44 | K | Joback Calculated Property |
| Vc | 0.891 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [611.60; 685.74] | J/mol×K | [691.88; 876.45] |
|
| Cp,gas | 611.60 | J/mol×K | 691.88 | Joback Calculated Property |
| Cp,gas | 625.78 | J/mol×K | 722.64 | Joback Calculated Property |
| Cp,gas | 639.19 | J/mol×K | 753.40 | Joback Calculated Property |
| Cp,gas | 651.86 | J/mol×K | 784.16 | Joback Calculated Property |
| Cp,gas | 663.82 | J/mol×K | 814.92 | Joback Calculated Property |
| Cp,gas | 675.10 | J/mol×K | 845.68 | Joback Calculated Property |
| Cp,gas | 685.74 | J/mol×K | 876.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Valeramide, 5-chloro-N-(5-chlorovaleryl)-N-propyl-.
Sources
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