- InChI
- InChI=1S/C21H29NO/c1-3-5-7-10-17-22(16-6-4-2)21(23)20-15-11-13-18-12-8-9-14-19(18)20/h8-9,11-15H,3-7,10,16-17H2,1-2H3
- InChI Key
- GUWXZGNWBTXFHY-UHFFFAOYSA-N
- Formula
- C21H29NO
- SMILES
-
CCCCCCN(CCCC)C(=O)c1cccc2ccccc
12 - Molecular Weight1
- 311.46
- 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° | 317.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -105.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.71 | kJ/mol | Joback Calculated Property |
| log10WS | -6.77 | Crippen Calculated Property | |
| logPoct/wat | 5.662 | Crippen Calculated Property | |
| McVol | 275.080 | ml/mol | McGowan Calculated Property |
| Pc | 1465.73 | kPa | Joback Calculated Property |
| Inp | [3039.00; 3039.00] |
|
|
| Inp | 3039.00 | NIST | |
| Inp | 3039.00 | NIST | |
| Tboil | 796.83 | K | Joback Calculated Property |
| Tc | 1002.39 | K | Joback Calculated Property |
| Tfus | 480.47 | K | Joback Calculated Property |
| Vc | 1.050 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [827.88; 918.33] | J/mol×K | [796.83; 1002.39] |
|
| Cp,gas | 827.88 | J/mol×K | 796.83 | Joback Calculated Property |
| Cp,gas | 845.28 | J/mol×K | 831.09 | Joback Calculated Property |
| Cp,gas | 861.63 | J/mol×K | 865.35 | Joback Calculated Property |
| Cp,gas | 877.03 | J/mol×K | 899.61 | Joback Calculated Property |
| Cp,gas | 891.56 | J/mol×K | 933.87 | Joback Calculated Property |
| Cp,gas | 905.29 | J/mol×K | 968.13 | Joback Calculated Property |
| Cp,gas | 918.33 | J/mol×K | 1002.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Naphthamide, N-butyl-N-hexyl-.
Sources
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