- InChI
- InChI=1S/C14H25Cl2NO2/c1-12(2)11-17(13(18)7-3-5-9-15)14(19)8-4-6-10-16/h12H,3-11H2,1-2H3
- InChI Key
- RETMFOIPBFYLHW-UHFFFAOYSA-N
- Formula
- C14H25Cl2NO2
- SMILES
-
CC(C)CN(C(=O)CCCCCl)C(=O)CCCCC
l - Molecular Weight1
- 310.26
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8192 | Relay (1.0) Calculated Property | |
| ΔfG° | -106.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -668.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.38 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.816 | Crippen Calculated Property | |
| McVol | 245.720 | ml/mol | McGowan Calculated Property |
| Pc | 1594.89 | kPa | Joback Calculated Property |
| Inp | [2201.00; 2201.00] |
|
|
| Inp | 2201.00 | NIST | |
| Inp | 2201.00 | NIST | |
| Tboil | 578.24 | K | Relay (1.0) Calculated Property |
| Tc | 798.18 | K | Relay (1.0) Calculated Property |
| Tfus | 318.22 | K | Relay (1.0) Calculated Property |
| Vc | 0.886 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [666.28; 743.59] | J/mol×K | [714.32; 900.64] |
|
| Cp,gas | 666.28 | J/mol×K | 714.32 | Joback Calculated Property |
| Cp,gas | 681.11 | J/mol×K | 745.37 | Joback Calculated Property |
| Cp,gas | 695.12 | J/mol×K | 776.43 | Joback Calculated Property |
| Cp,gas | 708.33 | J/mol×K | 807.48 | Joback Calculated Property |
| Cp,gas | 720.79 | J/mol×K | 838.54 | Joback Calculated Property |
| Cp,gas | 732.53 | J/mol×K | 869.59 | Joback Calculated Property |
| Cp,gas | 743.59 | J/mol×K | 900.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Valeramide, 5-chloro-N-(5-chlorovaleryl)-N-isobutyl-.
Sources
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