- InChI
- InChI=1S/C8H10O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h5-6H,1-4H2/t5-,6-/m0/s1
- InChI Key
- MUTGBJKUEZFXGO-WDSKDSINSA-N
- Formula
- C8H10O3
- SMILES
- O=C1OC(=O)C2CCCCC12
- Molecular Weight1
- 154.16
- CAS
- 14166-21-3
- Other Names
-
- trans-Cyclohexane-1,2-dicarboxylic anhydride
- Hexahydro-2-benzofuran-1,3-dione, trans
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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 |
|---|---|---|---|
| ΔcH°solid | -3919.60 ± 0.20 | kJ/mol | NIST |
| ΔfG° | -229.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -488.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.75 | kJ/mol | Joback Calculated Property |
| log10WS | -1.12 | Crippen Calculated Property | |
| logPoct/wat | 0.876 | Crippen Calculated Property | |
| McVol | 110.870 | ml/mol | McGowan Calculated Property |
| Pc | 3955.54 | kPa | Joback Calculated Property |
| Tboil | 571.32 | K | Joback Calculated Property |
| Tc | 824.11 | K | Joback Calculated Property |
| Tfus | 368.25 | K | Joback Calculated Property |
| Vc | 0.408 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [291.71; 378.03] | J/mol×K | [571.32; 824.11] | 
|
| Cp,gas | 291.71 | J/mol×K | 571.32 | Joback Calculated Property |
| Cp,gas | 308.71 | J/mol×K | 613.45 | Joback Calculated Property |
| Cp,gas | 324.69 | J/mol×K | 655.58 | Joback Calculated Property |
| Cp,gas | 339.63 | J/mol×K | 697.72 | Joback Calculated Property |
| Cp,gas | 353.51 | J/mol×K | 739.85 | Joback Calculated Property |
| Cp,gas | 366.32 | J/mol×K | 781.98 | Joback Calculated Property |
| Cp,gas | 378.03 | J/mol×K | 824.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Isobenzofurandione, hexahydro-, trans-.
Sources
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