- InChI
- InChI=1S/C11H22O2/c1-3-5-6-7-10-8-9-12-11(4-2)13-10/h10-11H,3-9H2,1-2H3/t10-,11+/m0/s1
- InChI Key
- UCGYQTHBPZXKHC-WDEREUQCSA-N
- Formula
- C11H22O2
- SMILES
- CCCCCC1CCOC(CC)O1
- Molecular Weight1
- 186.29
- 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).
- I : 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° | -113.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -500.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.22 | kJ/mol | Joback Calculated Property |
| log10WS | -3.22 | Crippen Calculated Property | |
| logPoct/wat | 3.108 | Crippen Calculated Property | |
| McVol | 166.730 | ml/mol | McGowan Calculated Property |
| Pc | 2224.99 | kPa | Joback Calculated Property |
| I | [1477.00; 1477.00] |
|
|
| I | 1477.00 | NIST | |
| I | 1477.00 | NIST | |
| Tboil | 519.86 | K | Joback Calculated Property |
| Tc | 712.81 | K | Joback Calculated Property |
| Tfus | 270.01 | K | Joback Calculated Property |
| Vc | 0.625 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [416.76; 518.84] | J/mol×K | [519.86; 712.81] |
|
| Cp,gas | 416.76 | J/mol×K | 519.86 | Joback Calculated Property |
| Cp,gas | 435.96 | J/mol×K | 552.02 | Joback Calculated Property |
| Cp,gas | 454.26 | J/mol×K | 584.18 | Joback Calculated Property |
| Cp,gas | 471.69 | J/mol×K | 616.34 | Joback Calculated Property |
| Cp,gas | 488.24 | J/mol×K | 648.49 | Joback Calculated Property |
| Cp,gas | 503.96 | J/mol×K | 680.65 | Joback Calculated Property |
| Cp,gas | 518.84 | J/mol×K | 712.81 | Joback Calculated Property |
| η | [0.0002794; 0.0055245] | Pa×s | [270.01; 519.86] |
|
| η | 0.0055245 | Pa×s | 270.01 | Joback Calculated Property |
| η | 0.0024098 | Pa×s | 311.65 | Joback Calculated Property |
| η | 0.0012782 | Pa×s | 353.29 | Joback Calculated Property |
| η | 0.0007750 | Pa×s | 394.94 | Joback Calculated Property |
| η | 0.0005170 | Pa×s | 436.58 | Joback Calculated Property |
| η | 0.0003700 | Pa×s | 478.22 | Joback Calculated Property |
| η | 0.0002794 | Pa×s | 519.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dioxane, 2-ethyl-4-pentyl, 2S,4R.
Sources
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