- InChI
- InChI=1S/C14H18O2/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H,15,16)
- InChI Key
- AAJLPPDFIRPBDA-UHFFFAOYSA-N
- Formula
- C14H18O2
- SMILES
- O=C(O)C(c1ccccc1)C1CCCCC1
- Molecular Weight1
- 218.29
- CAS
- 3894-09-5
- Other Names
-
- «alpha»-Cyclohexylphenylacetic acid
- Benzeneacetic acid, «alpha»-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° | -64.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -311.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.50 | kJ/mol | Joback Calculated Property |
| log10WS | -3.50 | Crippen Calculated Property | |
| logPoct/wat | 3.435 | Crippen Calculated Property | |
| McVol | 180.940 | ml/mol | McGowan Calculated Property |
| Pc | 2881.21 | kPa | Joback Calculated Property |
| Tboil | 711.56 | K | Joback Calculated Property |
| Tc | 935.19 | K | Joback Calculated Property |
| Tfus | 415.70 ± 1.50 | K | NIST |
| Vc | 0.663 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [520.72; 600.10] | J/mol×K | [711.56; 935.19] | 
|
| Cp,gas | 520.72 | J/mol×K | 711.56 | Joback Calculated Property |
| Cp,gas | 536.78 | J/mol×K | 748.83 | Joback Calculated Property |
| Cp,gas | 551.63 | J/mol×K | 786.10 | Joback Calculated Property |
| Cp,gas | 565.33 | J/mol×K | 823.37 | Joback Calculated Property |
| Cp,gas | 577.94 | J/mol×K | 860.65 | Joback Calculated Property |
| Cp,gas | 589.51 | J/mol×K | 897.92 | Joback Calculated Property |
| Cp,gas | 600.10 | J/mol×K | 935.19 | Joback Calculated Property |
| η | [0.0000433; 0.0048802] | Pa×s | [377.09; 711.56] |
|
| η | 0.0048802 | Pa×s | 377.09 | Joback Calculated Property |
| η | 0.0013374 | Pa×s | 432.84 | Joback Calculated Property |
| η | 0.0004925 | Pa×s | 488.58 | Joback Calculated Property |
| η | 0.0002225 | Pa×s | 544.33 | Joback Calculated Property |
| η | 0.0001165 | Pa×s | 600.07 | Joback Calculated Property |
| η | 0.0000681 | Pa×s | 655.81 | Joback Calculated Property |
| η | 0.0000433 | Pa×s | 711.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexylphenylacetic acid.
Sources
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