- InChI
- InChI=1S/C23H38ClNO/c1-5-9-11-19(7-3)17-25(18-20(8-4)12-10-6-2)23(26)21-13-15-22(24)16-14-21/h13-16,19-20H,5-12,17-18H2,1-4H3
- InChI Key
- MMHNMAOTACRUMR-UHFFFAOYSA-N
- Formula
- C23H38ClNO
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)c1
ccc(Cl)cc1 - Molecular Weight1
- 380.01
- 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 | 0.8917 | Relay (1.0) Calculated Property | |
| ΔfG° | 210.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -465.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 50.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.62 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.07 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.215 | Crippen Calculated Property | |
| McVol | 334.960 | ml/mol | McGowan Calculated Property |
| Pc | 1061.02 | kPa | Joback Calculated Property |
| Inp | [2438.00; 2438.00] |
|
|
| Inp | 2438.00 | NIST | |
| Inp | 2438.00 | NIST | |
| Tboil | 666.85 | K | Relay (1.0) Calculated Property |
| Tc | 867.85 | K | Relay (1.0) Calculated Property |
| Tfus | 281.15 | K | Relay (1.0) Calculated Property |
| Vc | 1.195 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1050.47; 1146.00] | J/mol×K | [860.16; 1060.88] |
|
| Cp,gas | 1050.47 | J/mol×K | 860.16 | Joback Calculated Property |
| Cp,gas | 1069.02 | J/mol×K | 893.61 | Joback Calculated Property |
| Cp,gas | 1086.43 | J/mol×K | 927.07 | Joback Calculated Property |
| Cp,gas | 1102.76 | J/mol×K | 960.52 | Joback Calculated Property |
| Cp,gas | 1118.09 | J/mol×K | 993.97 | Joback Calculated Property |
| Cp,gas | 1132.48 | J/mol×K | 1027.43 | Joback Calculated Property |
| Cp,gas | 1146.00 | J/mol×K | 1060.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-bis(2-ethylhexyl)-4-chloro-.
Sources
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