- InChI
- InChI=1S/C15H24N2O/c1-4-6-11-16-14-9-7-8-10-15(14)17(12-5-2)13(3)18/h7-10,16H,4-6,11-12H2,1-3H3
- InChI Key
- QOMVYJXUBOJUGH-UHFFFAOYSA-N
- Formula
- C15H24N2O
- SMILES
- CCCCNc1ccccc1N(CCC)C(C)=O
- Molecular Weight1
- 248.36
- 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° | 249.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -119.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.15 | kJ/mol | Joback Calculated Property |
| log10WS | -3.68 | Crippen Calculated Property | |
| logPoct/wat | 3.661 | Crippen Calculated Property | |
| McVol | 219.980 | ml/mol | McGowan Calculated Property |
| Pc | 1944.08 | kPa | Joback Calculated Property |
| Inp | [1872.00; 1872.00] |
|
|
| Inp | 1872.00 | NIST | |
| Inp | 1872.00 | NIST | |
| Tboil | 690.74 | K | Joback Calculated Property |
| Tc | 889.16 | K | Joback Calculated Property |
| Tfus | 432.81 | K | Joback Calculated Property |
| Vc | 0.827 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [614.63; 700.26] | J/mol×K | [690.74; 889.16] |
|
| Cp,gas | 614.63 | J/mol×K | 690.74 | Joback Calculated Property |
| Cp,gas | 631.21 | J/mol×K | 723.81 | Joback Calculated Property |
| Cp,gas | 646.81 | J/mol×K | 756.88 | Joback Calculated Property |
| Cp,gas | 661.47 | J/mol×K | 789.95 | Joback Calculated Property |
| Cp,gas | 675.23 | J/mol×K | 823.02 | Joback Calculated Property |
| Cp,gas | 688.15 | J/mol×K | 856.09 | Joback Calculated Property |
| Cp,gas | 700.26 | J/mol×K | 889.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Aminoacetanilide, N-propyl-N'-butyl.
Sources
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