- InChI
- InChI=1S/C8H12O5/c1-5(9)12-7-3-11-4-8(7)13-6(2)10/h7-8H,3-4H2,1-2H3
- InChI Key
- UTLGQZBGMVTJJZ-UHFFFAOYSA-N
- Formula
- C8H12O5
- SMILES
- CC(=O)OC1COCC1OC(C)=O
- Molecular Weight1
- 188.18
- CAS
- 85440-70-6
- ω : Acentric Factor.
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5296 | Relay (... Calculated Property | |
| ΔcH°liquid | -3885.10 ± 3.70 | kJ/mol | NIST |
| ΔfG° | -508.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -918.83 | kJ/mol | Relay (... Calculated Property |
| ΔfH°liquid | -978.00 ± 3.70 | kJ/mol | NIST |
| ΔfusH° | 25.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.36 | kJ/mol | Relay (... Calculated Property |
| IE | 9.78 | eV | Relay (... Calculated Property |
| log10WS | -0.74 | Relay (... Calculated Property | |
| logPoct/wat | -0.120 | Crippen Calculated Property | |
| McVol | 133.470 | ml/mol | McGowan Calculated Property |
| Pc | 3243.03 | kPa | Joback Calculated Property |
| Tboil | 513.22 | K | Relay (... Calculated Property |
| Tc | 683.86 | K | Relay (... Calculated Property |
| Tfus | 290.89 | K | Relay (... Calculated Property |
| Vc | 0.503 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [338.96; 410.53] | J/mol×K | [572.58; 781.77] | 
|
| Cp,gas | 338.96 | J/mol×K | 572.58 | Joback Calculated Property |
| Cp,gas | 352.65 | J/mol×K | 607.44 | Joback Calculated Property |
| Cp,gas | 365.65 | J/mol×K | 642.31 | Joback Calculated Property |
| Cp,gas | 377.95 | J/mol×K | 677.17 | Joback Calculated Property |
| Cp,gas | 389.54 | J/mol×K | 712.04 | Joback Calculated Property |
| Cp,gas | 400.40 | J/mol×K | 746.90 | Joback Calculated Property |
| Cp,gas | 410.53 | J/mol×K | 781.77 | Joback Calculated Property |
| η | [0.0003459; 0.0020438] | Pa×s | [357.47; 572.58] |
|
| η | 0.0020438 | Pa×s | 357.47 | Joback Calculated Property |
| η | 0.0013282 | Pa×s | 393.32 | Joback Calculated Property |
| η | 0.0009275 | Pa×s | 429.17 | Joback Calculated Property |
| η | 0.0006846 | Pa×s | 465.02 | Joback Calculated Property |
| η | 0.0005278 | Pa×s | 500.88 | Joback Calculated Property |
| η | 0.0004213 | Pa×s | 536.73 | Joback Calculated Property |
| η | 0.0003459 | Pa×s | 572.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Oxolane-3,4-diol dinitrate.
Sources
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