- InChI
- InChI=1S/C23H39NO/c1-5-9-14-21(8-4)19-24(18-17-20(7-3)13-6-2)23(25)22-15-11-10-12-16-22/h10-12,15-16,20-21H,5-9,13-14,17-19H2,1-4H3
- InChI Key
- BZOJFEXBZUIMDQ-UHFFFAOYSA-N
- Formula
- C23H39NO
- SMILES
-
CCCCC(CC)CN(CCC(CC)CCC)C(=O)c1
ccccc1 - 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 | 0.8683 | Relay (1.0) Calculated Property | |
| ΔfG° | 232.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -404.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.15 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.562 | Crippen Calculated Property | |
| McVol | 322.720 | ml/mol | McGowan Calculated Property |
| Pc | 1097.90 | kPa | Joback Calculated Property |
| Inp | [2366.00; 2366.00] |
|
|
| Inp | 2366.00 | NIST | |
| Inp | 2366.00 | NIST | |
| Tboil | 653.77 | K | Relay (1.0) Calculated Property |
| Tc | 858.70 | K | Relay (1.0) Calculated Property |
| Tfus | 253.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.164 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1018.62; 1120.87] | J/mol×K | [817.75; 1012.13] |
|
| Cp,gas | 1018.62 | J/mol×K | 817.75 | Joback Calculated Property |
| Cp,gas | 1038.36 | J/mol×K | 850.15 | Joback Calculated Property |
| Cp,gas | 1056.93 | J/mol×K | 882.54 | Joback Calculated Property |
| Cp,gas | 1074.41 | J/mol×K | 914.94 | Joback Calculated Property |
| Cp,gas | 1090.84 | J/mol×K | 947.34 | Joback Calculated Property |
| Cp,gas | 1106.31 | J/mol×K | 979.73 | Joback Calculated Property |
| Cp,gas | 1120.87 | J/mol×K | 1012.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-di(2-ethylhexyl)-.
Sources
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