- InChI
- InChI=1S/C20H13ClO4/c21-15-7-4-8-16(13-15)24-19(22)11-12-20(23)25-18-10-3-6-14-5-1-2-9-17(14)18/h1-13H/b12-11+
- InChI Key
- NEPIPLKTFAXJJO-VAWYXSNFSA-N
- Formula
- C20H13ClO4
- SMILES
-
O=C(C=CC(=O)Oc1cccc2ccccc12)Oc
1cccc(Cl)c1 - Molecular Weight1
- 352.77
- 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).
- Inp : Non-polar retention indices.
- 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° | 30.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -203.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.28 | kJ/mol | Joback Calculated Property |
| log10WS | -6.09 | Crippen Calculated Property | |
| logPoct/wat | 4.560 | Crippen Calculated Property | |
| McVol | 248.500 | ml/mol | McGowan Calculated Property |
| Pc | 2155.30 | kPa | Joback Calculated Property |
| Inp | [2916.00; 2916.00] |
|
|
| Inp | 2916.00 | NIST | |
| Inp | 2916.00 | NIST | |
| Tboil | 933.47 | K | Joback Calculated Property |
| Tc | 1187.29 | K | Joback Calculated Property |
| Tfus | 594.90 | K | Joback Calculated Property |
| Vc | 0.939 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [693.23; 746.04] | J/mol×K | [933.47; 1187.29] |
|
| Cp,gas | 693.23 | J/mol×K | 933.47 | Joback Calculated Property |
| Cp,gas | 704.16 | J/mol×K | 975.77 | Joback Calculated Property |
| Cp,gas | 714.09 | J/mol×K | 1018.08 | Joback Calculated Property |
| Cp,gas | 723.14 | J/mol×K | 1060.38 | Joback Calculated Property |
| Cp,gas | 731.40 | J/mol×K | 1102.69 | Joback Calculated Property |
| Cp,gas | 739.00 | J/mol×K | 1144.99 | Joback Calculated Property |
| Cp,gas | 746.04 | J/mol×K | 1187.29 | Joback Calculated Property |
| η | [0.0000889; 0.0004738] | Pa×s | [594.90; 933.47] |
|
| η | 0.0004738 | Pa×s | 594.90 | Joback Calculated Property |
| η | 0.0003177 | Pa×s | 651.33 | Joback Calculated Property |
| η | 0.0002270 | Pa×s | 707.76 | Joback Calculated Property |
| η | 0.0001705 | Pa×s | 764.19 | Joback Calculated Property |
| η | 0.0001332 | Pa×s | 820.61 | Joback Calculated Property |
| η | 0.0001074 | Pa×s | 877.04 | Joback Calculated Property |
| η | 0.0000889 | Pa×s | 933.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, naphth-1-yl 3-chlorophenyl ester.
Sources
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