- InChI
- InChI=1S/C25H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-25(26)24-21-18-17-19-22-24/h17-19,21-22H,2-16,20,23H2,1H3
- InChI Key
- KPWVFNOPNOTYNJ-UHFFFAOYSA-N
- Formula
- C25H42O2
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)c1cccc
c1 - Molecular Weight1
- 374.60
- CAS
- 10578-34-4
- Other Names
-
- octadecyl benzoate
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | 38.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -567.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.68 | kJ/mol | Joback Calculated Property |
| log10WS | -8.83 | Crippen Calculated Property | |
| logPoct/wat | 8.105 | Crippen Calculated Property | |
| McVol | 346.790 | ml/mol | McGowan Calculated Property |
| Pc | 952.01 | kPa | Joback Calculated Property |
| Inp | [2843.20; 2860.00] |
|
|
| Inp | 2843.20 | NIST | |
| Inp | 2860.00 | NIST | |
| Tboil | 874.37 | K | Joback Calculated Property |
| Tc | 1072.27 | K | Joback Calculated Property |
| Tfus | 470.09 | K | Joback Calculated Property |
| Vc | 1.351 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1129.86; 1230.10] | J/mol×K | [874.37; 1072.27] |
|
| Cp,gas | 1129.86 | J/mol×K | 874.37 | Joback Calculated Property |
| Cp,gas | 1149.45 | J/mol×K | 907.35 | Joback Calculated Property |
| Cp,gas | 1167.82 | J/mol×K | 940.34 | Joback Calculated Property |
| Cp,gas | 1185.01 | J/mol×K | 973.32 | Joback Calculated Property |
| Cp,gas | 1201.09 | J/mol×K | 1006.30 | Joback Calculated Property |
| Cp,gas | 1216.10 | J/mol×K | 1039.29 | Joback Calculated Property |
| Cp,gas | 1230.10 | J/mol×K | 1072.27 | Joback Calculated Property |
| η | [0.0000370; 0.0007543] | Pa×s | [470.09; 874.37] |
|
| η | 0.0007543 | Pa×s | 470.09 | Joback Calculated Property |
| η | 0.0003330 | Pa×s | 537.47 | Joback Calculated Property |
| η | 0.0001764 | Pa×s | 604.85 | Joback Calculated Property |
| η | 0.0001061 | Pa×s | 672.23 | Joback Calculated Property |
| η | 0.0000700 | Pa×s | 739.61 | Joback Calculated Property |
| η | 0.0000495 | Pa×s | 806.99 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 874.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, octadecyl ester.
Sources
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