- InChI
- InChI=1S/C16H17NO/c18-16(13-7-1-2-8-13)17-15-11-5-9-12-6-3-4-10-14(12)15/h3-6,9-11,13H,1-2,7-8H2,(H,17,18)
- InChI Key
- OIAFDYISGAVWKU-UHFFFAOYSA-N
- Formula
- C16H17NO
- SMILES
- O=C(Nc1cccc2ccccc12)C1CCCC1
- Molecular Weight1
- 239.31
- 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° | 290.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 43.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.23 | kJ/mol | Joback Calculated Property |
| log10WS | -4.81 | Crippen Calculated Property | |
| logPoct/wat | 3.969 | Crippen Calculated Property | |
| McVol | 193.770 | ml/mol | McGowan Calculated Property |
| Pc | 2665.27 | kPa | Joback Calculated Property |
| Inp | 2304.00 | NIST | |
| Tboil | 735.44 | K | Joback Calculated Property |
| Tc | 983.34 | K | Joback Calculated Property |
| Tfus | 455.21 | K | Joback Calculated Property |
| Vc | 0.728 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [553.95; 637.29] | J/mol×K | [735.44; 983.34] | 
|
| Cp,gas | 553.95 | J/mol×K | 735.44 | Joback Calculated Property |
| Cp,gas | 570.84 | J/mol×K | 776.76 | Joback Calculated Property |
| Cp,gas | 586.36 | J/mol×K | 818.07 | Joback Calculated Property |
| Cp,gas | 600.64 | J/mol×K | 859.39 | Joback Calculated Property |
| Cp,gas | 613.80 | J/mol×K | 900.71 | Joback Calculated Property |
| Cp,gas | 625.98 | J/mol×K | 942.02 | Joback Calculated Property |
| Cp,gas | 637.29 | J/mol×K | 983.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanecarboxamide, N-(1-naphthyl)-.
Sources
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