- InChI
- InChI=1S/C16H29Cl2NO2/c1-2-3-4-9-14-19(15(20)10-5-7-12-17)16(21)11-6-8-13-18/h2-14H2,1H3
- InChI Key
- AQBXHVHEIJYJDC-UHFFFAOYSA-N
- Formula
- C16H29Cl2NO2
- SMILES
-
CCCCCCN(C(=O)CCCCCl)C(=O)CCCCC
l - Molecular Weight1
- 338.31
- 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° | -87.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -562.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.95 | Crippen Calculated Property | |
| logPoct/wat | 4.740 | Crippen Calculated Property | |
| McVol | 273.900 | ml/mol | McGowan Calculated Property |
| Pc | 1367.69 | kPa | Joback Calculated Property |
| Inp | 2438.00 | NIST | |
| Tboil | 760.52 | K | Joback Calculated Property |
| Tc | 944.78 | K | Joback Calculated Property |
| Tfus | 462.25 | K | Joback Calculated Property |
| Vc | 1.060 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [777.51; 858.20] | J/mol×K | [760.52; 944.78] | 
|
| Cp,gas | 777.51 | J/mol×K | 760.52 | Joback Calculated Property |
| Cp,gas | 792.95 | J/mol×K | 791.23 | Joback Calculated Property |
| Cp,gas | 807.54 | J/mol×K | 821.94 | Joback Calculated Property |
| Cp,gas | 821.33 | J/mol×K | 852.65 | Joback Calculated Property |
| Cp,gas | 834.34 | J/mol×K | 883.36 | Joback Calculated Property |
| Cp,gas | 846.62 | J/mol×K | 914.07 | Joback Calculated Property |
| Cp,gas | 858.20 | J/mol×K | 944.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Valeramide, 5-chloro-N-(5-chlorovaleryl)-N-hexyl-.
Sources
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