- InChI
- InChI=1S/C19H18Br2O4/c1-3-19(4-2,17(22)24-15-9-5-13(20)6-10-15)18(23)25-16-11-7-14(21)8-12-16/h5-12H,3-4H2,1-2H3
- InChI Key
- VESLXVWAXROJTR-UHFFFAOYSA-N
- Formula
- C19H18Br2O4
- SMILES
-
CCC(CC)(C(=O)Oc1ccc(Br)cc1)C(=
O)Oc1ccc(Br)cc1 - Molecular Weight1
- 470.15
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7866 | Relay (1.0) Calculated Property | |
| ΔfG° | -121.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -541.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 116.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.34 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.529 | Crippen Calculated Property | |
| McVol | 280.930 | ml/mol | McGowan Calculated Property |
| Pc | 2141.36 | kPa | Joback Calculated Property |
| Inp | [2868.00; 2868.00] |
|
|
| Inp | 2868.00 | NIST | |
| Inp | 2868.00 | NIST | |
| Tboil | 683.94 | K | Relay (1.0) Calculated Property |
| Tc | 939.10 | K | Relay (1.0) Calculated Property |
| Tfus | 382.68 | K | Relay (1.0) Calculated Property |
| Vc | 0.944 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [785.70; 835.69] | J/mol×K | [979.11; 1233.03] |
|
| Cp,gas | 785.70 | J/mol×K | 979.11 | Joback Calculated Property |
| Cp,gas | 796.31 | J/mol×K | 1021.43 | Joback Calculated Property |
| Cp,gas | 805.87 | J/mol×K | 1063.75 | Joback Calculated Property |
| Cp,gas | 814.48 | J/mol×K | 1106.07 | Joback Calculated Property |
| Cp,gas | 822.25 | J/mol×K | 1148.39 | Joback Calculated Property |
| Cp,gas | 829.29 | J/mol×K | 1190.71 | Joback Calculated Property |
| Cp,gas | 835.69 | J/mol×K | 1233.03 | Joback Calculated Property |
| η | [0.0000302; 0.0001988] | Pa×s | [648.11; 979.11] |
|
| η | 0.0001988 | Pa×s | 648.11 | Joback Calculated Property |
| η | 0.0001284 | Pa×s | 703.28 | Joback Calculated Property |
| η | 0.0000884 | Pa×s | 758.44 | Joback Calculated Property |
| η | 0.0000640 | Pa×s | 813.61 | Joback Calculated Property |
| η | 0.0000483 | Pa×s | 868.78 | Joback Calculated Property |
| η | 0.0000377 | Pa×s | 923.94 | Joback Calculated Property |
| η | 0.0000302 | Pa×s | 979.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, di(4-bromophenyl) ester.
Sources
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