- InChI
- InChI=1S/C13H24O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h12H,2-11H2,1H3
- InChI Key
- QNVYTFRSSXVBQH-UHFFFAOYSA-N
- Formula
- C13H24O2
- SMILES
- CCCCCCOC(=O)C1CCCCC1
- Molecular Weight1
- 212.33
- CAS
- 27948-10-3
- Other Names
-
- hexyl cyclohexanecarboxylate
- 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° | -150.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -502.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.12 | kJ/mol | Joback Calculated Property |
| log10WS | -3.78 | Crippen Calculated Property | |
| logPoct/wat | 3.690 | Crippen Calculated Property | |
| McVol | 190.610 | ml/mol | McGowan Calculated Property |
| Pc | 2038.23 | kPa | Joback Calculated Property |
| Inp | [1506.12; 1509.71] |
|
|
| Inp | 1506.12 | NIST | |
| Inp | 1509.71 | NIST | |
| Inp | 1506.12 | NIST | |
| Tboil | 592.68 | K | Joback Calculated Property |
| Tc | 789.39 | K | Joback Calculated Property |
| Tfus | 315.81 | K | Joback Calculated Property |
| Vc | 0.721 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [506.49; 609.03] | J/mol×K | [592.68; 789.39] |
|
| Cp,gas | 506.49 | J/mol×K | 592.68 | Joback Calculated Property |
| Cp,gas | 526.03 | J/mol×K | 625.46 | Joback Calculated Property |
| Cp,gas | 544.57 | J/mol×K | 658.25 | Joback Calculated Property |
| Cp,gas | 562.11 | J/mol×K | 691.03 | Joback Calculated Property |
| Cp,gas | 578.69 | J/mol×K | 723.82 | Joback Calculated Property |
| Cp,gas | 594.33 | J/mol×K | 756.60 | Joback Calculated Property |
| Cp,gas | 609.03 | J/mol×K | 789.39 | Joback Calculated Property |
| η | [0.0001818; 0.0036457] | Pa×s | [315.81; 592.68] |
|
| η | 0.0036457 | Pa×s | 315.81 | Joback Calculated Property |
| η | 0.0016084 | Pa×s | 361.95 | Joback Calculated Property |
| η | 0.0008539 | Pa×s | 408.10 | Joback Calculated Property |
| η | 0.0005155 | Pa×s | 454.25 | Joback Calculated Property |
| η | 0.0003416 | Pa×s | 500.39 | Joback Calculated Property |
| η | 0.0002426 | Pa×s | 546.53 | Joback Calculated Property |
| η | 0.0001818 | Pa×s | 592.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxylic acid, hexyl ester.
Sources
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