- InChI
- InChI=1S/C14H21NO/c1-6-15(13(16)14(3,4)5)12-9-7-8-11(2)10-12/h7-10H,6H2,1-5H3
- InChI Key
- ZAROPWXBNKPAFL-UHFFFAOYSA-N
- Formula
- C14H21NO
- SMILES
- CCN(C(=O)C(C)(C)C)c1cccc(C)c1
- Molecular Weight1
- 219.32
- 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 | 0.5625 | Relay (1.0) Calculated Property | |
| ΔfG° | 154.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.394 | Crippen Calculated Property | |
| McVol | 195.910 | ml/mol | McGowan Calculated Property |
| Pc | 2131.49 | kPa | Joback Calculated Property |
| Inp | 1522.00 | NIST | |
| Tboil | 555.47 | K | Relay (1.0) Calculated Property |
| Tc | 762.27 | K | Relay (1.0) Calculated Property |
| Tfus | 302.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.724 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [507.66; 597.58] | J/mol×K | [614.46; 826.05] | 
|
| Cp,gas | 507.66 | J/mol×K | 614.46 | Joback Calculated Property |
| Cp,gas | 525.34 | J/mol×K | 649.73 | Joback Calculated Property |
| Cp,gas | 541.85 | J/mol×K | 684.99 | Joback Calculated Property |
| Cp,gas | 557.26 | J/mol×K | 720.26 | Joback Calculated Property |
| Cp,gas | 571.64 | J/mol×K | 755.52 | Joback Calculated Property |
| Cp,gas | 585.06 | J/mol×K | 790.79 | Joback Calculated Property |
| Cp,gas | 597.58 | J/mol×K | 826.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N-ethyl-N-(3-methylphenyl)-2,2-dimethyl-.
Sources
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