- InChI
- InChI=1S/C25H43NO/c1-4-7-9-10-11-12-13-14-15-16-22-26(21-8-5-2)25(27)24-19-17-23(6-3)18-20-24/h17-20H,4-16,21-22H2,1-3H3
- InChI Key
- XHDDRDHVZIDYBE-UHFFFAOYSA-N
- Formula
- C25H43NO
- SMILES
-
CCCCCCCCCCCCN(CCCC)C(=O)c1ccc(
CC)cc1 - Molecular Weight1
- 373.62
- 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 | 1.0590 | Relay (1.0) Calculated Property | |
| ΔfG° | 244.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -442.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.412 | Crippen Calculated Property | |
| McVol | 350.900 | ml/mol | McGowan Calculated Property |
| Pc | 952.01 | kPa | Joback Calculated Property |
| Inp | [2077.00; 2077.00] |
|
|
| Inp | 2077.00 | NIST | |
| Inp | 2077.00 | NIST | |
| Tboil | 668.91 | K | Relay (1.0) Calculated Property |
| Tc | 873.55 | K | Relay (1.0) Calculated Property |
| Tfus | 287.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.325 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1141.75; 1245.51] | J/mol×K | [869.37; 1066.48] |
|
| Cp,gas | 1141.75 | J/mol×K | 869.37 | Joback Calculated Property |
| Cp,gas | 1161.74 | J/mol×K | 902.22 | Joback Calculated Property |
| Cp,gas | 1180.56 | J/mol×K | 935.07 | Joback Calculated Property |
| Cp,gas | 1198.28 | J/mol×K | 967.93 | Joback Calculated Property |
| Cp,gas | 1214.97 | J/mol×K | 1000.78 | Joback Calculated Property |
| Cp,gas | 1230.69 | J/mol×K | 1033.63 | Joback Calculated Property |
| Cp,gas | 1245.51 | J/mol×K | 1066.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-ethyl-N-butyl-N-dodecyl-.
Sources
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