- 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° | 24.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.67 | 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 | 768.89 | K | Relay (1.0) Calculated Property |
| Tfus | 325.21 | 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 | [526.75; 614.89] | J/mol×K | [652.20; 843.77] | 
|
| Cp,gas | 526.75 | J/mol×K | 652.20 | Joback Calculated Property |
| Cp,gas | 543.67 | J/mol×K | 684.13 | Joback Calculated Property |
| Cp,gas | 559.69 | J/mol×K | 716.06 | Joback Calculated Property |
| Cp,gas | 574.81 | J/mol×K | 747.99 | Joback Calculated Property |
| Cp,gas | 589.05 | J/mol×K | 779.91 | Joback Calculated Property |
| Cp,gas | 602.41 | J/mol×K | 811.84 | Joback Calculated Property |
| Cp,gas | 614.89 | J/mol×K | 843.77 | Joback Calculated Property |
| η | [0.0000720; 0.0061433] | Pa×s | [341.88; 652.20] |
|
| η | 0.0061433 | Pa×s | 341.88 | Joback Calculated Property |
| η | 0.0017993 | Pa×s | 393.60 | Joback Calculated Property |
| η | 0.0007009 | Pa×s | 445.32 | Joback Calculated Property |
| η | 0.0003322 | Pa×s | 497.04 | Joback Calculated Property |
| η | 0.0001813 | Pa×s | 548.76 | Joback Calculated Property |
| η | 0.0001098 | Pa×s | 600.48 | Joback Calculated Property |
| η | 0.0000720 | Pa×s | 652.20 | 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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