- InChI
- InChI=1S/C6H2Br2O4/c7-1-3(9)5(11)2(8)6(12)4(1)10/h9,12H
- InChI Key
- GMZWPTALVQRAFV-UHFFFAOYSA-N
- Formula
- C6H2Br2O4
- SMILES
- O=C1C(O)=C(Br)C(=O)C(O)=C1Br
- Molecular Weight1
- 297.89
- CAS
- 4370-59-6
- Other Names
-
- Bromanilic acid
- 2,5-Cyclohexadiene-1,4-dione, 2,5-dibromo-3,6-dihydroxy-
- 2,5-Dibromo-3,6-dihydroxyquinone
- 2,5-Dibromo-3,6-dihydroxy-p-benzoquinone
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -436.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -550.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.64 | kJ/mol | Joback Calculated Property |
| log10WS | -1.99 | Crippen Calculated Property | |
| logPoct/wat | 1.467 | Crippen Calculated Property | |
| McVol | 125.820 | ml/mol | McGowan Calculated Property |
| Pc | 7535.20 | kPa | Joback Calculated Property |
| Tboil | 831.46 | K | Joback Calculated Property |
| Tc | 1066.95 | K | Joback Calculated Property |
| Tfus | 598.28 | K | Joback Calculated Property |
| Vc | 0.454 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.86; 289.37] | J/mol×K | [831.46; 1066.95] | 
|
| Cp,gas | 268.86 | J/mol×K | 831.46 | Joback Calculated Property |
| Cp,gas | 274.01 | J/mol×K | 870.71 | Joback Calculated Property |
| Cp,gas | 278.53 | J/mol×K | 909.96 | Joback Calculated Property |
| Cp,gas | 282.38 | J/mol×K | 949.21 | Joback Calculated Property |
| Cp,gas | 285.50 | J/mol×K | 988.45 | Joback Calculated Property |
| Cp,gas | 287.84 | J/mol×K | 1027.70 | Joback Calculated Property |
| Cp,gas | 289.37 | J/mol×K | 1066.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to p-Benzoquinone, 2,5-dibromo-3,6-dihydroxy-.
Sources
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