- InChI
- InChI=1S/C19H24O2/c1-12-3-13(2)5-17(4-12)21-18(20)19-9-14-6-15(10-19)8-16(7-14)11-19/h3-5,14-16H,6-11H2,1-2H3
- InChI Key
- FQRPDLFZZYNVAZ-UHFFFAOYSA-N
- Formula
- C19H24O2
- SMILES
-
Cc1cc(C)cc(OC(=O)C23CC4CC(CC(C
4)C2)C3)c1 - Molecular Weight1
- 284.39
- 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° | 125.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -259.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.09 | kJ/mol | Joback Calculated Property |
| log10WS | -5.22 | Crippen Calculated Property | |
| logPoct/wat | 4.425 | Crippen Calculated Property | |
| McVol | 229.670 | ml/mol | McGowan Calculated Property |
| Pc | 1944.08 | kPa | Joback Calculated Property |
| Inp | 2240.00 | NIST | |
| Tboil | 767.11 | K | Joback Calculated Property |
| Tc | 1004.92 | K | Joback Calculated Property |
| Tfus | 497.47 | K | Joback Calculated Property |
| Vc | 0.875 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [722.96; 839.84] | J/mol×K | [767.11; 1004.92] | 
|
| Cp,gas | 722.96 | J/mol×K | 767.11 | Joback Calculated Property |
| Cp,gas | 743.66 | J/mol×K | 806.75 | Joback Calculated Property |
| Cp,gas | 763.54 | J/mol×K | 846.38 | Joback Calculated Property |
| Cp,gas | 782.84 | J/mol×K | 886.02 | Joback Calculated Property |
| Cp,gas | 801.83 | J/mol×K | 925.65 | Joback Calculated Property |
| Cp,gas | 820.75 | J/mol×K | 965.29 | Joback Calculated Property |
| Cp,gas | 839.84 | J/mol×K | 1004.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Adamantanecarboxylic acid, 3,5-dimethylphenyl ester.
Sources
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