- InChI
- InChI=1S/C23H39NO/c1-4-6-8-10-12-14-19-24(18-13-11-9-7-5-2)23(25)22-17-15-16-21(3)20-22/h15-17,20H,4-14,18-19H2,1-3H3
- InChI Key
- HMMZOGRVIFQFJU-UHFFFAOYSA-N
- Formula
- C23H39NO
- SMILES
-
CCCCCCCCN(CCCCCCC)C(=O)c1cccc(
C)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 | 0.9862 | Relay (1.0) Calculated Property | |
| ΔfG° | 227.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -401.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.768 | Crippen Calculated Property | |
| McVol | 322.720 | ml/mol | McGowan Calculated Property |
| Pc | 1075.69 | kPa | Joback Calculated Property |
| Inp | [2553.00; 2553.00] |
|
|
| Inp | 2553.00 | NIST | |
| Inp | 2553.00 | NIST | |
| Tboil | 660.96 | K | Relay (1.0) Calculated Property |
| Tc | 861.45 | K | Relay (1.0) Calculated Property |
| Tfus | 286.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.215 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1017.67; 1118.47] | J/mol×K | [823.61; 1015.94] |
|
| Cp,gas | 1017.67 | J/mol×K | 823.61 | Joback Calculated Property |
| Cp,gas | 1037.04 | J/mol×K | 855.66 | Joback Calculated Property |
| Cp,gas | 1055.30 | J/mol×K | 887.72 | Joback Calculated Property |
| Cp,gas | 1072.52 | J/mol×K | 919.77 | Joback Calculated Property |
| Cp,gas | 1088.75 | J/mol×K | 951.83 | Joback Calculated Property |
| Cp,gas | 1104.04 | J/mol×K | 983.88 | Joback Calculated Property |
| Cp,gas | 1118.47 | J/mol×K | 1015.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-heptyl-N-octyl-3-methyl-.
Sources
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