- InChI
- InChI=1S/C23H39NO/c1-3-5-6-7-8-9-10-11-12-16-21-24(4-2)23(25)20-19-22-17-14-13-15-18-22/h13-15,17-18H,3-12,16,19-21H2,1-2H3
- InChI Key
- RYAMYFMNZGUIRE-UHFFFAOYSA-N
- Formula
- C23H39NO
- SMILES
-
CCCCCCCCCCCCN(CC)C(=O)CCc1cccc
c1 - Molecular Weight1
- 345.56
- 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 | 0.9616 | Relay (1.0) Calculated Property | |
| ΔfG° | 237.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -387.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.33 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.389 | Crippen Calculated Property | |
| McVol | 322.720 | ml/mol | McGowan Calculated Property |
| Pc | 1086.35 | kPa | Joback Calculated Property |
| Inp | [3104.00; 3104.00] |
|
|
| Inp | 3104.00 | NIST | |
| Inp | 3104.00 | NIST | |
| Tboil | 642.79 | K | Relay (1.0) Calculated Property |
| Tc | 857.27 | K | Relay (1.0) Calculated Property |
| Tfus | 290.44 | K | Relay (1.0) Calculated Property |
| Vc | 1.213 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1017.68; 1118.92] | J/mol×K | [818.63; 1010.05] |
|
| Cp,gas | 1017.68 | J/mol×K | 818.63 | Joback Calculated Property |
| Cp,gas | 1037.13 | J/mol×K | 850.53 | Joback Calculated Property |
| Cp,gas | 1055.46 | J/mol×K | 882.44 | Joback Calculated Property |
| Cp,gas | 1072.74 | J/mol×K | 914.34 | Joback Calculated Property |
| Cp,gas | 1089.04 | J/mol×K | 946.24 | Joback Calculated Property |
| Cp,gas | 1104.42 | J/mol×K | 978.15 | Joback Calculated Property |
| Cp,gas | 1118.92 | J/mol×K | 1010.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, 3-phenyl-N-ethyl-N-dodecyl-.
Sources
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