- InChI
- InChI=1S/C4H2Cl2O2/c5-3(7)1-2-4(6)8/h1-2H/b2-1+
- InChI Key
- ZLYYJUJDFKGVKB-OWOJBTEDSA-N
- Formula
- C4H2Cl2O2
- SMILES
- O=C(Cl)C=CC(=O)Cl
- Molecular Weight1
- 152.96
- CAS
- 627-63-4
- Other Names
-
- Fumaroyl chloride
- 2-Butenedioyl dichloride, (E)-
- Chlorure de fumaryle
- Dichlorid kyseliny fumarove
- Fumaroyl dichloride
- Fumarylchlorid
- TL 189
- UN 1780
- (2E)-2-Butenedioyl dichloride
- 2-Butenedioyl dichloride, (2E)-
- Fumaryl dichloride
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -218.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -265.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.72 | kJ/mol | Joback Calculated Property |
| log10WS | -1.21 | Crippen Calculated Property | |
| logPoct/wat | 1.073 | Crippen Calculated Property | |
| McVol | 90.540 | ml/mol | McGowan Calculated Property |
| Pc | 4456.32 | kPa | Joback Calculated Property |
| Tboil | [432.20; 435.70] | K |
|
| Tboil | 435.70 | K | NIST |
| Tboil | 432.20 | K | NIST |
| Tc | 694.89 | K | Joback Calculated Property |
| Tfus | 289.46 | K | Joback Calculated Property |
| Vc | 0.349 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [143.21; 169.11] | J/mol×K | [477.68; 694.89] |
|
| Cp,gas | 143.21 | J/mol×K | 477.68 | Joback Calculated Property |
| Cp,gas | 148.44 | J/mol×K | 513.88 | Joback Calculated Property |
| Cp,gas | 153.28 | J/mol×K | 550.08 | Joback Calculated Property |
| Cp,gas | 157.74 | J/mol×K | 586.28 | Joback Calculated Property |
| Cp,gas | 161.85 | J/mol×K | 622.48 | Joback Calculated Property |
| Cp,gas | 165.63 | J/mol×K | 658.68 | Joback Calculated Property |
| Cp,gas | 169.11 | J/mol×K | 694.89 | Joback Calculated Property |
| η | [0.0003909; 0.0030050] | Pa×s | [289.46; 477.68] |
|
| η | 0.0030050 | Pa×s | 289.46 | Joback Calculated Property |
| η | 0.0018115 | Pa×s | 320.83 | Joback Calculated Property |
| η | 0.0011951 | Pa×s | 352.20 | Joback Calculated Property |
| η | 0.0008439 | Pa×s | 383.57 | Joback Calculated Property |
| η | 0.0006281 | Pa×s | 414.94 | Joback Calculated Property |
| η | 0.0004873 | Pa×s | 446.31 | Joback Calculated Property |
| η | 0.0003909 | Pa×s | 477.68 | Joback Calculated Property |
| ΔvapH | 45.60 | kJ/mol | 360.50 | NIST |
Similar Compounds
Find more compounds similar to Fumaryl chloride.
Sources
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