- InChI
- InChI=1S/C22H43NO/c1-3-5-7-9-13-19-23(20-14-10-8-6-4-2)22(24)18-17-21-15-11-12-16-21/h21H,3-20H2,1-2H3
- InChI Key
- XEVNPAKTLRPCEN-UHFFFAOYSA-N
- Formula
- C22H43NO
- SMILES
-
CCCCCCCN(CCCCCCC)C(=O)CCC1CCCC
1 - Molecular Weight1
- 337.58
- 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 | 0.9082 | Relay (1.0) Calculated Property | |
| ΔfG° | 152.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -594.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 51.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.79 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.90 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.726 | Crippen Calculated Property | |
| McVol | 321.530 | ml/mol | McGowan Calculated Property |
| Pc | 1048.01 | kPa | Joback Calculated Property |
| Inp | 2474.00 | NIST | |
| Tboil | 640.95 | K | Relay (1.0) Calculated Property |
| Tc | 843.70 | K | Relay (1.0) Calculated Property |
| Tfus | 281.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.207 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1035.78; 1148.77] | J/mol×K | [784.35; 968.35] | 
|
| Cp,gas | 1035.78 | J/mol×K | 784.35 | Joback Calculated Property |
| Cp,gas | 1057.33 | J/mol×K | 815.02 | Joback Calculated Property |
| Cp,gas | 1077.71 | J/mol×K | 845.68 | Joback Calculated Property |
| Cp,gas | 1096.99 | J/mol×K | 876.35 | Joback Calculated Property |
| Cp,gas | 1115.23 | J/mol×K | 907.02 | Joback Calculated Property |
| Cp,gas | 1132.47 | J/mol×K | 937.69 | Joback Calculated Property |
| Cp,gas | 1148.77 | J/mol×K | 968.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-diheptyl-3-cyclopentyl-.
Sources
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