- InChI
- InChI=1S/C13H16O2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h6-10H,1-5H2,(H,14,15)
- InChI Key
- QCIWHVKGVVQHIY-UHFFFAOYSA-N
- Formula
- C13H16O2
- SMILES
- O=C(O)c1ccc(C2CCCCC2)cc1
- Molecular Weight1
- 204.26
- CAS
- 20029-52-1
- Other Names
-
- 4-Cyclohexylbenzoic acid
- Benzoic acid, 4-cyclohexyl-
- 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).
- 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° | -79.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -297.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.32 | kJ/mol | Joback Calculated Property |
| log10WS | -3.87 | Crippen Calculated Property | |
| logPoct/wat | 3.433 | Crippen Calculated Property | |
| McVol | 166.850 | ml/mol | McGowan Calculated Property |
| Pc | 3121.00 | kPa | Joback Calculated Property |
| Tboil | 694.10 | K | Joback Calculated Property |
| Tc | 918.25 | K | Joback Calculated Property |
| Tfus | 393.34 | K | Joback Calculated Property |
| Vc | 0.614 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [466.22; 542.00] | J/mol×K | [694.10; 918.25] | 
|
| Cp,gas | 466.22 | J/mol×K | 694.10 | Joback Calculated Property |
| Cp,gas | 481.49 | J/mol×K | 731.46 | Joback Calculated Property |
| Cp,gas | 495.64 | J/mol×K | 768.82 | Joback Calculated Property |
| Cp,gas | 508.72 | J/mol×K | 806.17 | Joback Calculated Property |
| Cp,gas | 520.77 | J/mol×K | 843.53 | Joback Calculated Property |
| Cp,gas | 531.85 | J/mol×K | 880.89 | Joback Calculated Property |
| Cp,gas | 542.00 | J/mol×K | 918.25 | Joback Calculated Property |
| η | [0.0000546; 0.0028999] | Pa×s | [393.34; 694.10] |
|
| η | 0.0028999 | Pa×s | 393.34 | Joback Calculated Property |
| η | 0.0010286 | Pa×s | 443.47 | Joback Calculated Property |
| η | 0.0004504 | Pa×s | 493.59 | Joback Calculated Property |
| η | 0.0002296 | Pa×s | 543.72 | Joback Calculated Property |
| η | 0.0001312 | Pa×s | 593.85 | Joback Calculated Property |
| η | 0.0000818 | Pa×s | 643.97 | Joback Calculated Property |
| η | 0.0000546 | Pa×s | 694.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to p-Cyclohexylbenzoic acid.
Sources
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