- InChI
- InChI=1S/C18H23NO/c1-2-3-4-5-6-7-11-14-18(20)19-16-15-17-12-9-8-10-13-17/h2-5,8-14H,6-7,15-16H2,1H3,(H,19,20)/b3-2+,5-4-,14-11+
- InChI Key
- ZVLFTTDBSQNTOB-RSQSAPEFSA-N
- Formula
- C18H23NO
- SMILES
- CC=CC=CCCC=CC(=O)NCCc1ccccc1
- Molecular Weight1
- 269.38
- 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 | 0.6416 | Relay (1.0) Calculated Property | |
| ΔfG° | 414.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -59.39 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.76 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.814 | Crippen Calculated Property | |
| McVol | 239.370 | ml/mol | McGowan Calculated Property |
| Pc | 1760.97 | kPa | Joback Calculated Property |
| Inp | [2006.00; 2006.00] |
|
|
| Inp | 2006.00 | NIST | |
| Inp | 2006.00 | NIST | |
| Tboil | 617.08 | K | Relay (1.0) Calculated Property |
| Tc | 852.12 | K | Relay (1.0) Calculated Property |
| Tfus | 347.39 | K | Relay (1.0) Calculated Property |
| Vc | 0.808 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [669.45; 752.94] | J/mol×K | [754.44; 967.59] |
|
| Cp,gas | 669.45 | J/mol×K | 754.44 | Joback Calculated Property |
| Cp,gas | 685.47 | J/mol×K | 789.96 | Joback Calculated Property |
| Cp,gas | 700.51 | J/mol×K | 825.49 | Joback Calculated Property |
| Cp,gas | 714.68 | J/mol×K | 861.01 | Joback Calculated Property |
| Cp,gas | 728.07 | J/mol×K | 896.54 | Joback Calculated Property |
| Cp,gas | 740.79 | J/mol×K | 932.06 | Joback Calculated Property |
| Cp,gas | 752.94 | J/mol×K | 967.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-(2-Phenylethyl)(2E,6Z,8E)-decatrienamide.
Sources
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