- InChI
- InChI=1S/C13H22O2/c1-4-14-13(12-7-5-6-8-12)15-10-9-11(2)3/h5-7,11,13H,4,8-10H2,1-3H3
- InChI Key
- KZDDWXGYZGWAFF-UHFFFAOYSA-N
- Formula
- C13H22O2
- SMILES
- CCOC(OCCC(C)C)C1=CC=CC1
- Molecular Weight1
- 210.31
- 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° | -61.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -401.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.39 | kJ/mol | Joback Calculated Property |
| log10WS | -3.41 | Crippen Calculated Property | |
| logPoct/wat | 3.298 | Crippen Calculated Property | |
| McVol | 186.310 | ml/mol | McGowan Calculated Property |
| Pc | 2040.07 | kPa | Joback Calculated Property |
| I | [1652.00; 1652.00] |
|
|
| I | 1652.00 | NIST | |
| I | 1652.00 | NIST | |
| Tboil | 564.05 | K | Joback Calculated Property |
| Tc | 757.24 | K | Joback Calculated Property |
| Tfus | 279.91 | K | Joback Calculated Property |
| Vc | 0.702 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [466.30; 559.89] | J/mol×K | [564.05; 757.24] |
|
| Cp,gas | 466.30 | J/mol×K | 564.05 | Joback Calculated Property |
| Cp,gas | 483.96 | J/mol×K | 596.25 | Joback Calculated Property |
| Cp,gas | 500.77 | J/mol×K | 628.45 | Joback Calculated Property |
| Cp,gas | 516.75 | J/mol×K | 660.65 | Joback Calculated Property |
| Cp,gas | 531.92 | J/mol×K | 692.84 | Joback Calculated Property |
| Cp,gas | 546.29 | J/mol×K | 725.04 | Joback Calculated Property |
| Cp,gas | 559.89 | J/mol×K | 757.24 | Joback Calculated Property |
| η | [0.0001421; 0.0034362] | Pa×s | [279.91; 564.05] |
|
| η | 0.0034362 | Pa×s | 279.91 | Joback Calculated Property |
| η | 0.0013761 | Pa×s | 327.27 | Joback Calculated Property |
| η | 0.0006946 | Pa×s | 374.62 | Joback Calculated Property |
| η | 0.0004087 | Pa×s | 421.98 | Joback Calculated Property |
| η | 0.0002677 | Pa×s | 469.34 | Joback Calculated Property |
| η | 0.0001894 | Pa×s | 516.69 | Joback Calculated Property |
| η | 0.0001421 | Pa×s | 564.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to furfural ethyl isoamyl acetal.
Sources
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