- 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
- CAS
- 21722-83-8
- Other Names
-
- 2-Cyclohexylethyl acetate
- Acetic acid, cyclohexylethyl ester
- Cyclohexane ethyl acetate
- Cyclohexylethyl acetate
- Ethylcyclohexyl acetate
- Hexahydrophenyl ethyl acetate
- 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.
- I : 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 |
|---|---|---|---|
| ΔfG° | -176.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -440.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.44 | kJ/mol | Joback Calculated Property |
| log10WS | -2.52 | Crippen Calculated Property | |
| logPoct/wat | 2.520 | Crippen Calculated Property | |
| McVol | 148.340 | ml/mol | McGowan Calculated Property |
| Pc | 2693.00 | kPa | Joback Calculated Property |
| Inp | [1233.00; 1233.00] |
|
|
| Inp | 1233.00 | NIST | |
| Inp | 1233.00 | NIST | |
| I | [1591.00; 1591.00] |
|
|
| I | 1591.00 | NIST | |
| I | 1591.00 | NIST | |
| I | 1591.00 | NIST | |
| Tboil | 524.04 | K | Joback Calculated Property |
| Tc | 729.39 | K | Joback Calculated Property |
| Tfus | 282.00 | K | Joback Calculated Property |
| Vc | 0.552 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [355.31; 449.24] | J/mol×K | [524.04; 729.39] |
|
| Cp,gas | 355.31 | J/mol×K | 524.04 | Joback Calculated Property |
| Cp,gas | 373.16 | J/mol×K | 558.27 | Joback Calculated Property |
| Cp,gas | 390.11 | J/mol×K | 592.49 | Joback Calculated Property |
| Cp,gas | 406.18 | J/mol×K | 626.72 | Joback Calculated Property |
| Cp,gas | 421.39 | J/mol×K | 660.94 | Joback Calculated Property |
| Cp,gas | 435.73 | J/mol×K | 695.17 | Joback Calculated Property |
| Cp,gas | 449.24 | J/mol×K | 729.39 | Joback Calculated Property |
| η | [0.0012600; 0.0025400] | Pa×s | [300.00; 340.00] |
|
| η | 0.0025400 | Pa×s | 300.00 | Tempera... |
| η | 0.0020700 | Pa×s | 310.00 | Tempera... |
| η | 0.0017200 | Pa×s | 320.00 | Tempera... |
| η | 0.0014600 | Pa×s | 330.00 | Tempera... |
| η | 0.0012600 | Pa×s | 340.00 | Tempera... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 370.70 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to Cyclohexaneethanol, acetate.
Mixtures
Sources
- 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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