- InChI
- InChI=1S/C18H20O4/c1-2-18-20-13-17(22-18)12-19-14-8-10-16(11-9-14)21-15-6-4-3-5-7-15/h3-11,17-18H,2,12-13H2,1H3
- InChI Key
- ZDOOQPFIGYHZFV-UHFFFAOYSA-N
- Formula
- C18H20O4
- SMILES
-
CCC1OCC(COc2ccc(Oc3ccccc3)cc2)
O1 - Molecular Weight1
- 300.35
- CAS
- 63837-33-2
- Other Names
-
- 2-Ethyl-4-[(4-phenoxyphenoxy)methyl]-1,3-dioxolane
- Diofenolan
- 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° | -37.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -441.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.66 | kJ/mol | Joback Calculated Property |
| log10WS | -4.11 | Crippen Calculated Property | |
| logPoct/wat | 4.009 | Crippen Calculated Property | |
| McVol | 229.580 | ml/mol | McGowan Calculated Property |
| Pc | 2058.62 | kPa | Joback Calculated Property |
| Inp | [2459.00; 2459.00] |
|
|
| Inp | 2459.00 | NIST | |
| Inp | 2459.00 | NIST | |
| Tboil | 778.93 | K | Joback Calculated Property |
| Tc | 1017.42 | K | Joback Calculated Property |
| Tfus | 462.24 | K | Joback Calculated Property |
| Vc | 0.846 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [693.22; 778.33] | J/mol×K | [778.93; 1017.42] |
|
| Cp,gas | 693.22 | J/mol×K | 778.93 | Joback Calculated Property |
| Cp,gas | 711.17 | J/mol×K | 818.68 | Joback Calculated Property |
| Cp,gas | 727.56 | J/mol×K | 858.43 | Joback Calculated Property |
| Cp,gas | 742.42 | J/mol×K | 898.17 | Joback Calculated Property |
| Cp,gas | 755.81 | J/mol×K | 937.92 | Joback Calculated Property |
| Cp,gas | 767.77 | J/mol×K | 977.67 | Joback Calculated Property |
| Cp,gas | 778.33 | J/mol×K | 1017.42 | Joback Calculated Property |
| η | [0.0001103; 0.0008967] | Pa×s | [462.24; 778.93] |
|
| η | 0.0008967 | Pa×s | 462.24 | Joback Calculated Property |
| η | 0.0005288 | Pa×s | 515.02 | Joback Calculated Property |
| η | 0.0003440 | Pa×s | 567.80 | Joback Calculated Property |
| η | 0.0002408 | Pa×s | 620.59 | Joback Calculated Property |
| η | 0.0001782 | Pa×s | 673.37 | Joback Calculated Property |
| η | 0.0001378 | Pa×s | 726.15 | Joback Calculated Property |
| η | 0.0001103 | Pa×s | 778.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dioxolane, 2-ethyl-4-((4-phenoxyphenoxy)methyl)-.
Sources
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