- InChI
- InChI=1S/C21H43NO/c1-6-8-10-12-14-16-18-22(20(23)21(3,4)5)19-17-15-13-11-9-7-2/h6-19H2,1-5H3
- InChI Key
- VLQKBOOLSUBTLT-UHFFFAOYSA-N
- Formula
- C21H43NO
- SMILES
-
CCCCCCCCN(CCCCCCCC)C(=O)C(C)(C
)C - Molecular Weight1
- 325.57
- 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° | 110.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -530.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.83 | kJ/mol | Joback Calculated Property |
| log10WS | -6.72 | Crippen Calculated Property | |
| logPoct/wat | 6.582 | Crippen Calculated Property | |
| McVol | 318.300 | ml/mol | McGowan Calculated Property |
| Pc | 1005.26 | kPa | Joback Calculated Property |
| Inp | [2205.00; 2205.00] |
|
|
| Inp | 2205.00 | NIST | |
| Inp | 2205.00 | NIST | |
| Tboil | 742.96 | K | Joback Calculated Property |
| Tc | 917.86 | K | Joback Calculated Property |
| Tfus | 411.25 | K | Joback Calculated Property |
| Vc | 1.224 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [980.70; 1090.08] | J/mol×K | [742.96; 917.86] |
|
| Cp,gas | 980.70 | J/mol×K | 742.96 | Joback Calculated Property |
| Cp,gas | 1001.31 | J/mol×K | 772.11 | Joback Calculated Property |
| Cp,gas | 1020.90 | J/mol×K | 801.26 | Joback Calculated Property |
| Cp,gas | 1039.52 | J/mol×K | 830.41 | Joback Calculated Property |
| Cp,gas | 1057.22 | J/mol×K | 859.56 | Joback Calculated Property |
| Cp,gas | 1074.06 | J/mol×K | 888.71 | Joback Calculated Property |
| Cp,gas | 1090.08 | J/mol×K | 917.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-dioctyl-2,2-dimethyl-.
Sources
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