- InChI
- InChI=1S/C15H28O3/c1-3-4-5-6-7-12-18-15(16)13-8-10-14(17-2)11-9-13/h13-14H,3-12H2,1-2H3
- InChI Key
- MHTOVMNNTKKLEZ-UHFFFAOYSA-N
- Formula
- C15H28O3
- SMILES
- CCCCCCCOC(=O)C1CCC(OC)CC1
- Molecular Weight1
- 256.38
- 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° | -246.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -695.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.67 | kJ/mol | Joback Calculated Property |
| log10WS | -3.82 | Crippen Calculated Property | |
| logPoct/wat | 3.705 | Crippen Calculated Property | |
| McVol | 224.660 | ml/mol | McGowan Calculated Property |
| Pc | 1656.49 | kPa | Joback Calculated Property |
| Inp | [1843.00; 1843.00] |
|
|
| Inp | 1843.00 | NIST | |
| Inp | 1843.00 | NIST | |
| Tboil | 656.19 | K | Joback Calculated Property |
| Tc | 846.89 | K | Joback Calculated Property |
| Tfus | 356.34 | K | Joback Calculated Property |
| Vc | 0.850 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [646.96; 752.57] | J/mol×K | [656.19; 846.89] |
|
| Cp,gas | 646.96 | J/mol×K | 656.19 | Joback Calculated Property |
| Cp,gas | 667.14 | J/mol×K | 687.97 | Joback Calculated Property |
| Cp,gas | 686.28 | J/mol×K | 719.76 | Joback Calculated Property |
| Cp,gas | 704.39 | J/mol×K | 751.54 | Joback Calculated Property |
| Cp,gas | 721.47 | J/mol×K | 783.32 | Joback Calculated Property |
| Cp,gas | 737.53 | J/mol×K | 815.11 | Joback Calculated Property |
| Cp,gas | 752.57 | J/mol×K | 846.89 | Joback Calculated Property |
| η | [0.0001344; 0.0019602] | Pa×s | [356.34; 656.19] |
|
| η | 0.0019602 | Pa×s | 356.34 | Joback Calculated Property |
| η | 0.0009529 | Pa×s | 406.31 | Joback Calculated Property |
| η | 0.0005425 | Pa×s | 456.29 | Joback Calculated Property |
| η | 0.0003452 | Pa×s | 506.26 | Joback Calculated Property |
| η | 0.0002382 | Pa×s | 556.24 | Joback Calculated Property |
| η | 0.0001748 | Pa×s | 606.21 | Joback Calculated Property |
| η | 0.0001344 | Pa×s | 656.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxylic acid, 4-methoxy-, heptyl ester.
Sources
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