![3-Oxabicyclo[3.2.1.]octane-2,4-dione, 6,7-dihydroxy-, 6,7-diacetate](/cid/77-563-2/3-Oxabicyclo-3-2-1-octane-2-4-dione-6-7-dihydroxy-6-7-diacetate.png "3-Oxabicyclo[3.2.1.]octane-2,4-dione, 6,7-dihydroxy-, 6,7-diacetate")
- InChI
- InChI=1S/C11H12O7/c1-4(12)16-8-6-3-7(9(8)17-5(2)13)11(15)18-10(6)14/h6-9H,3H2,1-2H3
- InChI Key
- RDFHBGLKBDMTEX-UHFFFAOYSA-N
- Formula
- C11H12O7
- SMILES
-
CC(=O)OC1C2CC(C(=O)OC2=O)C1OC(
C)=O - Molecular Weight1
- 256.21
- CAS
- 13190-77-7
- 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° | -675.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1074.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.95 | kJ/mol | Joback Calculated Property |
| log10WS | -0.32 | Crippen Calculated Property | |
| logPoct/wat | -0.431 | Crippen Calculated Property | |
| McVol | 168.020 | ml/mol | McGowan Calculated Property |
| Pc | 2838.39 | kPa | Joback Calculated Property |
| Tboil | 778.93 | K | Joback Calculated Property |
| Tc | 1013.29 | K | Joback Calculated Property |
| Tfus | 541.42 | K | Joback Calculated Property |
| Vc | 0.630 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [533.01; 598.24] | J/mol×K | [778.93; 1013.29] | 
|
| Cp,gas | 533.01 | J/mol×K | 778.93 | Joback Calculated Property |
| Cp,gas | 547.45 | J/mol×K | 817.99 | Joback Calculated Property |
| Cp,gas | 560.55 | J/mol×K | 857.05 | Joback Calculated Property |
| Cp,gas | 572.23 | J/mol×K | 896.11 | Joback Calculated Property |
| Cp,gas | 582.44 | J/mol×K | 935.17 | Joback Calculated Property |
| Cp,gas | 591.13 | J/mol×K | 974.23 | Joback Calculated Property |
| Cp,gas | 598.24 | J/mol×K | 1013.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Oxabicyclo[3.2.1.]octane-2,4-dione, 6,7-dihydroxy-, 6,7-diacetate.
Sources
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