- InChI
- InChI=1S/C20H16Br2O6/c21-15-5-1-13(2-6-15)17(23)11-27-19(25)9-10-20(26)28-12-18(24)14-3-7-16(22)8-4-14/h1-8H,9-12H2
- InChI Key
- FNERLEDLNAIHAM-UHFFFAOYSA-N
- Formula
- C20H16Br2O6
- SMILES
-
O=C(CCC(=O)OCC(=O)c1ccc(Br)cc1
)OCC(=O)c1ccc(Br)cc1 - Molecular Weight1
- 512.14
- CAS
- 806-98-4
- 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° | -373.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -668.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.66 | kJ/mol | Joback Calculated Property |
| log10WS | -6.17 | Crippen Calculated Property | |
| logPoct/wat | 4.144 | Crippen Calculated Property | |
| McVol | 298.160 | ml/mol | McGowan Calculated Property |
| Pc | 2163.33 | kPa | Joback Calculated Property |
| Tboil | 1112.96 | K | Joback Calculated Property |
| Tc | 1371.25 | K | Joback Calculated Property |
| Tfus | 756.82 | K | Joback Calculated Property |
| Vc | 1.123 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [841.54; 862.40] | J/mol×K | [1112.96; 1371.25] | 
|
| Cp,gas | 841.54 | J/mol×K | 1112.96 | Joback Calculated Property |
| Cp,gas | 847.71 | J/mol×K | 1156.01 | Joback Calculated Property |
| Cp,gas | 852.71 | J/mol×K | 1199.06 | Joback Calculated Property |
| Cp,gas | 856.60 | J/mol×K | 1242.11 | Joback Calculated Property |
| Cp,gas | 859.47 | J/mol×K | 1285.16 | Joback Calculated Property |
| Cp,gas | 861.38 | J/mol×K | 1328.21 | Joback Calculated Property |
| Cp,gas | 862.40 | J/mol×K | 1371.25 | Joback Calculated Property |
| η | [0.0000298; 0.0001588] | Pa×s | [756.82; 1112.96] |
|
| η | 0.0001588 | Pa×s | 756.82 | Joback Calculated Property |
| η | 0.0001086 | Pa×s | 816.18 | Joback Calculated Property |
| η | 0.0000782 | Pa×s | 875.53 | Joback Calculated Property |
| η | 0.0000587 | Pa×s | 934.89 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 994.25 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 1053.60 | Joback Calculated Property |
| η | 0.0000298 | Pa×s | 1112.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Di-(p-bromophenacyl) succinate.
Sources
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