- InChI
- InChI=1S/C25H42ClNO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-22-27(4-2)25(28)23-18-20-24(26)21-19-23/h18-21H,3-17,22H2,1-2H3
- InChI Key
- WTPOCVBIHOAMHI-UHFFFAOYSA-N
- Formula
- C25H42ClNO
- SMILES
-
CCCCCCCCCCCCCCCCN(CC)C(=O)c1cc
c(Cl)cc1 - Molecular Weight1
- 408.06
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 232.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -395.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.36 | kJ/mol | Joback Calculated Property |
| log10WS | -9.00 | Crippen Calculated Property | |
| logPoct/wat | 8.283 | Crippen Calculated Property | |
| McVol | 363.140 | ml/mol | McGowan Calculated Property |
| Pc | 930.64 | kPa | Joback Calculated Property |
| Inp | [1533.00; 1533.00] |
|
|
| Inp | 1533.00 | NIST | |
| Inp | 1533.00 | NIST | |
| Tboil | 906.80 | K | Joback Calculated Property |
| Tc | 1111.03 | K | Joback Calculated Property |
| Tfus | 522.77 | K | Joback Calculated Property |
| Vc | 1.401 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1173.40; 1271.88] | J/mol×K | [906.80; 1111.03] |
|
| Cp,gas | 1173.40 | J/mol×K | 906.80 | Joback Calculated Property |
| Cp,gas | 1192.45 | J/mol×K | 940.84 | Joback Calculated Property |
| Cp,gas | 1210.35 | J/mol×K | 974.88 | Joback Calculated Property |
| Cp,gas | 1227.16 | J/mol×K | 1008.92 | Joback Calculated Property |
| Cp,gas | 1242.97 | J/mol×K | 1042.96 | Joback Calculated Property |
| Cp,gas | 1257.85 | J/mol×K | 1077.00 | Joback Calculated Property |
| Cp,gas | 1271.88 | J/mol×K | 1111.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-chloro-N-ethyl-N-hexadecyl-.
Sources
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