- InChI
- InChI=1S/C16H31NO/c1-3-5-7-9-13-17(14-10-8-6-4-2)16(18)15-11-12-15/h15H,3-14H2,1-2H3
- InChI Key
- TYYRCIALGZPLAR-UHFFFAOYSA-N
- Formula
- C16H31NO
- SMILES
- CCCCCCN(CCCCCC)C(=O)C1CC1
- Molecular Weight1
- 253.42
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7629 | Relay (1.0) Calculated Property | |
| ΔfG° | 126.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -412.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.21 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.386 | Crippen Calculated Property | |
| McVol | 236.990 | ml/mol | McGowan Calculated Property |
| Pc | 1522.31 | kPa | Joback Calculated Property |
| Inp | [1870.00; 1870.00] |
|
|
| Inp | 1870.00 | NIST | |
| Inp | 1870.00 | NIST | |
| Tboil | 574.69 | K | Relay (1.0) Calculated Property |
| Tc | 783.02 | K | Relay (1.0) Calculated Property |
| Tfus | 288.67 | K | Relay (1.0) Calculated Property |
| Vc | 0.910 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [672.02; 772.19] | J/mol×K | [638.53; 813.36] |
|
| Cp,gas | 672.02 | J/mol×K | 638.53 | Joback Calculated Property |
| Cp,gas | 690.88 | J/mol×K | 667.67 | Joback Calculated Property |
| Cp,gas | 708.82 | J/mol×K | 696.81 | Joback Calculated Property |
| Cp,gas | 725.87 | J/mol×K | 725.95 | Joback Calculated Property |
| Cp,gas | 742.08 | J/mol×K | 755.08 | Joback Calculated Property |
| Cp,gas | 757.51 | J/mol×K | 784.22 | Joback Calculated Property |
| Cp,gas | 772.19 | J/mol×K | 813.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxamide, N,N-dihexyl-.
Sources
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