- InChI
- InChI=1S/C11H20O2/c1-4-5-6-7-10-8-9-12-11(2,3)13-10/h5-6,10H,4,7-9H2,1-3H3/b6-5+/t10-/m0/s1
- InChI Key
- MCJLMZXXIYIDQK-PORFMDCZSA-N
- Formula
- C11H20O2
- SMILES
- CCC=CCC1CCOC(C)(C)O1
- Molecular Weight1
- 184.28
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | -39.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -367.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.03 | kJ/mol | Joback Calculated Property |
| log10WS | -3.07 | Crippen Calculated Property | |
| logPoct/wat | 2.884 | Crippen Calculated Property | |
| McVol | 162.430 | ml/mol | McGowan Calculated Property |
| Pc | 2443.48 | kPa | Joback Calculated Property |
| Tboil | 524.26 | K | Joback Calculated Property |
| Tc | 734.24 | K | Joback Calculated Property |
| Tfus | 288.83 | K | Joback Calculated Property |
| Vc | 0.604 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [399.15; 497.56] | J/mol×K | [524.26; 734.24] | 
|
| Cp,gas | 399.15 | J/mol×K | 524.26 | Joback Calculated Property |
| Cp,gas | 418.05 | J/mol×K | 559.26 | Joback Calculated Property |
| Cp,gas | 435.81 | J/mol×K | 594.25 | Joback Calculated Property |
| Cp,gas | 452.53 | J/mol×K | 629.25 | Joback Calculated Property |
| Cp,gas | 468.32 | J/mol×K | 664.24 | Joback Calculated Property |
| Cp,gas | 483.30 | J/mol×K | 699.24 | Joback Calculated Property |
| Cp,gas | 497.56 | J/mol×K | 734.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dioxane, 2,2-dimethyl-4-(2-pentenyl), 4R.
Sources
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