- InChI
- InChI=1S/C20H20O6/c21-20-15(6-13-2-4-17-19(8-13)26-11-24-17)14(9-22-20)5-12-1-3-16-18(7-12)25-10-23-16/h1-4,7-8,14-15,20-21H,5-6,9-11H2
- InChI Key
- DIYWRNLYKJKHAM-UHFFFAOYSA-N
- Formula
- C20H20O6
- SMILES
-
OC1OCC(Cc2ccc3c(c2)OCO3)C1Cc1c
cc2c(c1)OCO2 - Molecular Weight1
- 356.37
- CAS
- 18423-69-3
- Other Names
-
- (2S,3R,4R)-3,4-bis(Benzo[d][1,3]dioxol-5-ylmethyl)tetrahydrofuran-2-ol
- 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° | -105.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -635.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.63 | kJ/mol | Joback Calculated Property |
| log10WS | -4.35 | Crippen Calculated Property | |
| logPoct/wat | 2.510 | Crippen Calculated Property | |
| McVol | 247.780 | ml/mol | McGowan Calculated Property |
| Pc | 2381.86 | kPa | Joback Calculated Property |
| Inp | [3030.30; 3030.30] |
|
|
| Inp | 3030.30 | NIST | |
| Inp | 3030.30 | NIST | |
| Tboil | 985.97 | K | Joback Calculated Property |
| Tc | 1228.77 | K | Joback Calculated Property |
| Tfus | 658.53 | K | Joback Calculated Property |
| Vc | 0.918 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [856.25; 929.45] | J/mol×K | [985.97; 1228.77] |
|
| Cp,gas | 856.25 | J/mol×K | 985.97 | Joback Calculated Property |
| Cp,gas | 869.65 | J/mol×K | 1026.44 | Joback Calculated Property |
| Cp,gas | 882.37 | J/mol×K | 1066.90 | Joback Calculated Property |
| Cp,gas | 894.56 | J/mol×K | 1107.37 | Joback Calculated Property |
| Cp,gas | 906.37 | J/mol×K | 1147.83 | Joback Calculated Property |
| Cp,gas | 917.95 | J/mol×K | 1188.30 | Joback Calculated Property |
| Cp,gas | 929.45 | J/mol×K | 1228.77 | Joback Calculated Property |
| η | [0.0001134; 0.0007663] | Pa×s | [658.53; 985.97] |
|
| η | 0.0007663 | Pa×s | 658.53 | Joback Calculated Property |
| η | 0.0004934 | Pa×s | 713.10 | Joback Calculated Property |
| η | 0.0003382 | Pa×s | 767.68 | Joback Calculated Property |
| η | 0.0002437 | Pa×s | 822.25 | Joback Calculated Property |
| η | 0.0001830 | Pa×s | 876.82 | Joback Calculated Property |
| η | 0.0001420 | Pa×s | 931.40 | Joback Calculated Property |
| η | 0.0001134 | Pa×s | 985.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to tetrahydro-3,4-dipiperonylfuran-2-ol.
Sources
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