- InChI
- InChI=1S/C12H22O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3,(H,13,14)
- InChI Key
- CILPHQCEVYJUDN-UHFFFAOYSA-N
- Formula
- C12H22O3
- SMILES
- CC1CCC(C(C)C)C(OCC(=O)O)C1
- Molecular Weight1
- 214.30
- CAS
- 40248-63-3
- Other Names
-
- (-)-Menthoxyacetic acid
- (-)-Menthyloxyacetic acid
- Acetic acid, [[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-, [1R-(1«alpha»,2«beta»,5«alpha»)]-
- L-Menthoxyacetic acid
- L-p-menth-3-yloxyacetic acid
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 28.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.50 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 2.548 | Crippen Calculated Property | |
| McVol | 182.390 | ml/mol | McGowan Calculated Property |
| Tboil | 570.16 | K | Relay (1.0) Calculated Property |
| Tc | 777.05 | K | Relay (1.0) Calculated Property |
| Tfus | 319.43 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [529.39; 623.64] | J/mol×K | [651.86; 859.92] | 
|
| Cp,gas | 529.39 | J/mol×K | 651.86 | Joback Calculated Property |
| Cp,gas | 547.72 | J/mol×K | 686.54 | Joback Calculated Property |
| Cp,gas | 564.99 | J/mol×K | 721.21 | Joback Calculated Property |
| Cp,gas | 581.20 | J/mol×K | 755.89 | Joback Calculated Property |
| Cp,gas | 596.37 | J/mol×K | 790.57 | Joback Calculated Property |
| Cp,gas | 610.51 | J/mol×K | 825.24 | Joback Calculated Property |
| Cp,gas | 623.64 | J/mol×K | 859.92 | Joback Calculated Property |
| η | [0.0001948; 0.0014916] | Pa×s | [391.73; 651.86] |
|
| η | 0.0014916 | Pa×s | 391.73 | Joback Calculated Property |
| η | 0.0008973 | Pa×s | 435.08 | Joback Calculated Property |
| η | 0.0005918 | Pa×s | 478.44 | Joback Calculated Property |
| η | 0.0004183 | Pa×s | 521.79 | Joback Calculated Property |
| η | 0.0003118 | Pa×s | 565.15 | Joback Calculated Property |
| η | 0.0002424 | Pa×s | 608.50 | Joback Calculated Property |
| η | 0.0001948 | Pa×s | 651.86 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 436.70 | K | 1.30 | NIST |
Similar Compounds
Find more compounds similar to Levo-menthoxyacetic acid.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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