- InChI
- InChI=1S/C11H22ClNO/c1-2-3-4-7-10-13-11(14)8-5-6-9-12/h2-10H2,1H3,(H,13,14)
- InChI Key
- BAELMQSEJPMTLE-UHFFFAOYSA-N
- Formula
- C11H22ClNO
- SMILES
- CCCCCCNC(=O)CCCCCl
- Molecular Weight1
- 219.75
- 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° | -9.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -345.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.65 | kJ/mol | Joback Calculated Property |
| log10WS | -3.54 | Crippen Calculated Property | |
| logPoct/wat | 3.092 | Crippen Calculated Property | |
| McVol | 189.640 | ml/mol | McGowan Calculated Property |
| Pc | 2001.91 | kPa | Joback Calculated Property |
| Inp | [1824.00; 1824.00] |
|
|
| Inp | 1824.00 | NIST | |
| Inp | 1824.00 | NIST | |
| Tboil | 592.55 | K | Joback Calculated Property |
| Tc | 771.27 | K | Joback Calculated Property |
| Tfus | 346.24 | K | Joback Calculated Property |
| Vc | 0.742 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [473.67; 551.26] | J/mol×K | [592.55; 771.27] |
|
| Cp,gas | 473.67 | J/mol×K | 592.55 | Joback Calculated Property |
| Cp,gas | 488.22 | J/mol×K | 622.34 | Joback Calculated Property |
| Cp,gas | 502.11 | J/mol×K | 652.12 | Joback Calculated Property |
| Cp,gas | 515.33 | J/mol×K | 681.91 | Joback Calculated Property |
| Cp,gas | 527.92 | J/mol×K | 711.70 | Joback Calculated Property |
| Cp,gas | 539.89 | J/mol×K | 741.49 | Joback Calculated Property |
| Cp,gas | 551.26 | J/mol×K | 771.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Valeramide, 5-chloro-N-hexyl-.
Sources
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