- InChI
- InChI=1S/C10H18O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h10H,2-8H2,1H3
- InChI Key
- NOTFZGFABLVTIG-UHFFFAOYSA-N
- Formula
- C10H18O2
- SMILES
- CC(=O)OCCC1CCCCC1
- Molecular Weight1
- 170.25
- Other Names
-
- Acetic acid, cyclohexylethyl ester
- Cyclohexane ethyl acetate
- Cyclohexylethyl acetate
- Ethylcyclohexyl acetate
- Hexahydrophenyl ethyl acetate
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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.
- Ip : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ω | 0.4485 | Relay (1.0) Calculated Property | |
| ΔfG° | -252.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -531.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.60 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.46 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.99 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.520 | Crippen Calculated Property | |
| McVol | 148.340 | ml/mol | McGowan Calculated Property |
| Pc | 2581.96 | kPa | Joback Calculated Property |
| Inp | [1233.00; 1233.00] |
|
|
| Inp | 1233.00 | NIST | |
| Inp | 1233.00 | NIST | |
| Ip | [1591.00; 1591.00] |
|
|
| Ip | 1591.00 | NIST | |
| Ip | 1591.00 | NIST | |
| Ip | 1591.00 | NIST | |
| Tboil | 501.41 | K | Relay (1.0) Calculated Property |
| Tc | 707.30 | K | Relay (1.0) Calculated Property |
| Tfus | 233.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.528 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0012600; 0.0025400] | Pa×s | [300.00; 340.00] |
|
| η | 0.0025400 | Pa×s | 300.00 | Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material) |
| η | 0.0020700 | Pa×s | 310.00 | Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material) |
| η | 0.0017200 | Pa×s | 320.00 | Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material) |
| η | 0.0014600 | Pa×s | 330.00 | Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material) |
| η | 0.0012600 | Pa×s | 340.00 | Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material) |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 370.70 | K | 2.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [195.84; 528.42] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -4.63980e+01 | |||
| Coefficient B | 1.02112e+00 | |||
| Coefficient C | -5.06600e-04 | |||
| Coefficient D | 6.03000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 195.84 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 254.12 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 306.62 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 353.53 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 395.06 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 431.37 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 462.68 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 489.16 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 511.01 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 528.42 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-CYCLOHEXYLETHYL ACETATE.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Solubility of fragrance raw materials in water: Experimental study, correlations, and Mod. UNIFAC (Do) predictions
- Temperature and composition dependence of the density and viscosity of binary mixtures of (1-decanol + fragrance material)
- Joback Method
- McGowan Method
- NIST Webbook
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