- InChI
- InChI=1S/C27H36O2/c1-2-3-4-5-6-7-8-9-10-11-16-21-29-27(28)26-24-19-14-12-17-22(24)23-18-13-15-20-25(23)26/h12-15,17-20,26H,2-11,16,21H2,1H3
- InChI Key
- PBSHVWRIKCGEJA-UHFFFAOYSA-N
- Formula
- C27H36O2
- SMILES
-
CCCCCCCCCCCCCOC(=O)C1c2ccccc2-
c2ccccc21 - Molecular Weight1
- 392.57
- 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° | 233.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -310.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.30 | kJ/mol | Joback Calculated Property |
| log10WS | -9.11 | Crippen Calculated Property | |
| logPoct/wat | 7.653 | Crippen Calculated Property | |
| McVol | 340.350 | ml/mol | McGowan Calculated Property |
| Pc | 1073.57 | kPa | Joback Calculated Property |
| Inp | 3639.00 | NIST | |
| Tboil | 954.97 | K | Joback Calculated Property |
| Tc | 1173.00 | K | Joback Calculated Property |
| Tfus | 569.07 | K | Joback Calculated Property |
| Vc | 1.329 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1130.64; 1227.46] | J/mol×K | [954.97; 1173.00] | 
|
| Cp,gas | 1130.64 | J/mol×K | 954.97 | Joback Calculated Property |
| Cp,gas | 1148.68 | J/mol×K | 991.31 | Joback Calculated Property |
| Cp,gas | 1165.80 | J/mol×K | 1027.65 | Joback Calculated Property |
| Cp,gas | 1182.12 | J/mol×K | 1063.99 | Joback Calculated Property |
| Cp,gas | 1197.76 | J/mol×K | 1100.33 | Joback Calculated Property |
| Cp,gas | 1212.84 | J/mol×K | 1136.67 | Joback Calculated Property |
| Cp,gas | 1227.46 | J/mol×K | 1173.00 | Joback Calculated Property |
| η | [0.0002159; 0.0010614] | Pa×s | [569.07; 954.97] |
|
| η | 0.0010614 | Pa×s | 569.07 | Joback Calculated Property |
| η | 0.0007114 | Pa×s | 633.39 | Joback Calculated Property |
| η | 0.0005133 | Pa×s | 697.70 | Joback Calculated Property |
| η | 0.0003913 | Pa×s | 762.02 | Joback Calculated Property |
| η | 0.0003112 | Pa×s | 826.34 | Joback Calculated Property |
| η | 0.0002558 | Pa×s | 890.65 | Joback Calculated Property |
| η | 0.0002159 | Pa×s | 954.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9H-Fluorene-9-carboxylic acid, tridecyl ester.
Sources
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