- InChI
- InChI=1S/C6H6O4/c1-2-3(5(7)8)4(2)6(9)10/h3-4H,1H2,(H,7,8)(H,9,10)
- InChI Key
- XZVHROKAQFFOCA-UHFFFAOYSA-N
- Formula
- C6H6O4
- SMILES
- C=C1C(C(=O)O)C1C(=O)O
- Molecular Weight1
- 142.11
- CAS
- 45786-15-0
- 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).
- 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° | -425.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -560.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.56 | kJ/mol | Joback Calculated Property |
| log10WS | 0.20 | Crippen Calculated Property | |
| logPoct/wat | -0.042 | Crippen Calculated Property | |
| McVol | 95.120 | ml/mol | McGowan Calculated Property |
| Pc | 5343.52 | kPa | Joback Calculated Property |
| Tboil | 630.01 | K | Joback Calculated Property |
| Tc | 814.58 | K | Joback Calculated Property |
| Tfus | 406.26 | K | Joback Calculated Property |
| Vc | 0.361 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [241.93; 275.23] | J/mol×K | [630.01; 814.58] | 
|
| Cp,gas | 241.93 | J/mol×K | 630.01 | Joback Calculated Property |
| Cp,gas | 248.33 | J/mol×K | 660.77 | Joback Calculated Property |
| Cp,gas | 254.37 | J/mol×K | 691.53 | Joback Calculated Property |
| Cp,gas | 260.06 | J/mol×K | 722.29 | Joback Calculated Property |
| Cp,gas | 265.42 | J/mol×K | 753.06 | Joback Calculated Property |
| Cp,gas | 270.47 | J/mol×K | 783.82 | Joback Calculated Property |
| Cp,gas | 275.23 | J/mol×K | 814.58 | Joback Calculated Property |
| η | [0.0001224; 0.0036729] | Pa×s | [406.26; 630.01] |
|
| η | 0.0036729 | Pa×s | 406.26 | Joback Calculated Property |
| η | 0.0016417 | Pa×s | 443.55 | Joback Calculated Property |
| η | 0.0008314 | Pa×s | 480.84 | Joback Calculated Property |
| η | 0.0004644 | Pa×s | 518.13 | Joback Calculated Property |
| η | 0.0002805 | Pa×s | 555.43 | Joback Calculated Property |
| η | 0.0001805 | Pa×s | 592.72 | Joback Calculated Property |
| η | 0.0001224 | Pa×s | 630.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methylenecyclopropane-1,2-dicarboxylic acid.
Sources
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