- InChI
- InChI=1S/C6H8O3/c1-3-4(2)6(8)9-5(3)7/h3-4H,1-2H3/t3-,4+
- InChI Key
- HXFIRQHMXJBTRV-ZXZARUISSA-N
- Formula
- C6H8O3
- SMILES
- CC1C(=O)OC(=O)C1C
- Molecular Weight1
- 128.13
- CAS
- 16844-07-8
- 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 | -2846.40 ± 1.40 | kJ/mol | NIST |
| ΔfG° | -302.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -534.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.90 | kJ/mol | Joback Calculated Property |
| log10WS | -0.38 | Crippen Calculated Property | |
| logPoct/wat | 0.342 | Crippen Calculated Property | |
| McVol | 93.550 | ml/mol | McGowan Calculated Property |
| Pc | 3975.52 | kPa | Joback Calculated Property |
| Tboil | 509.88 | K | Joback Calculated Property |
| Tc | 744.55 | K | Joback Calculated Property |
| Tfus | 327.05 | K | Joback Calculated Property |
| Vc | 0.346 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [217.61; 289.01] | J/mol×K | [509.88; 744.55] | 
|
| Cp,gas | 217.61 | J/mol×K | 509.88 | Joback Calculated Property |
| Cp,gas | 230.78 | J/mol×K | 548.99 | Joback Calculated Property |
| Cp,gas | 243.53 | J/mol×K | 588.10 | Joback Calculated Property |
| Cp,gas | 255.78 | J/mol×K | 627.21 | Joback Calculated Property |
| Cp,gas | 267.49 | J/mol×K | 666.32 | Joback Calculated Property |
| Cp,gas | 278.58 | J/mol×K | 705.44 | Joback Calculated Property |
| Cp,gas | 289.01 | J/mol×K | 744.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-3,4-Dihydro-3,4-dimethyl-2,5-furandione.
Sources
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