- InChI
- InChI=1S/C15H22N2O3/c1-3-5-6-7-12-16(4-2)15(18)13-8-10-14(11-9-13)17(19)20/h8-11H,3-7,12H2,1-2H3
- InChI Key
- SPSZXGFYTQQXLX-UHFFFAOYSA-N
- Formula
- C15H22N2O3
- SMILES
-
CCCCCCN(CC)C(=O)c1ccc([N+](=O)
[O-])cc1 - Molecular Weight1
- 278.35
- 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° | 195.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -183.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.30 | kJ/mol | Joback Calculated Property |
| log10WS | -4.78 | Crippen Calculated Property | |
| logPoct/wat | 3.637 | Crippen Calculated Property | |
| McVol | 227.420 | ml/mol | McGowan Calculated Property |
| Pc | 1942.37 | kPa | Joback Calculated Property |
| Inp | [2389.00; 2389.00] |
|
|
| Inp | 2389.00 | NIST | |
| Inp | 2389.00 | NIST | |
| Tboil | 792.41 | K | Joback Calculated Property |
| Tc | 1010.62 | K | Joback Calculated Property |
| Tfus | 523.76 | K | Joback Calculated Property |
| Vc | 0.874 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [673.48; 747.81] | J/mol×K | [792.41; 1010.62] |
|
| Cp,gas | 673.48 | J/mol×K | 792.41 | Joback Calculated Property |
| Cp,gas | 688.25 | J/mol×K | 828.78 | Joback Calculated Property |
| Cp,gas | 701.98 | J/mol×K | 865.15 | Joback Calculated Property |
| Cp,gas | 714.74 | J/mol×K | 901.52 | Joback Calculated Property |
| Cp,gas | 726.59 | J/mol×K | 937.88 | Joback Calculated Property |
| Cp,gas | 737.60 | J/mol×K | 974.25 | Joback Calculated Property |
| Cp,gas | 747.81 | J/mol×K | 1010.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-nitro-N-ethyl-N-hexyl-.
Sources
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