- InChI
- InChI=1S/C7H4Br2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
- InChI Key
- SFTFNJZWZHASAQ-UHFFFAOYSA-N
- Formula
- C7H4Br2O2
- SMILES
- O=C(O)c1cc(Br)cc(Br)c1
- Molecular Weight1
- 279.91
- CAS
- 618-58-6
- Other Names
-
- Benzoic acid, 3,5-dibromo-
- 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° | -135.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -186.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.07 | kJ/mol | Joback Calculated Property |
| log10WS | -3.86 | Crippen Calculated Property | |
| logPoct/wat | 2.910 | Crippen Calculated Property | |
| McVol | 128.170 | ml/mol | McGowan Calculated Property |
| Pc | 5953.74 | kPa | Joback Calculated Property |
| Tboil | 674.57 | K | Joback Calculated Property |
| Tc | 911.01 | K | Joback Calculated Property |
| Tfus | 491.20 | K | Vapor p... |
| Vc | 0.469 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [243.39; 273.46] | J/mol×K | [674.57; 911.01] | 
|
| Cp,gas | 243.39 | J/mol×K | 674.57 | Joback Calculated Property |
| Cp,gas | 249.49 | J/mol×K | 713.98 | Joback Calculated Property |
| Cp,gas | 255.10 | J/mol×K | 753.38 | Joback Calculated Property |
| Cp,gas | 260.26 | J/mol×K | 792.79 | Joback Calculated Property |
| Cp,gas | 265.01 | J/mol×K | 832.20 | Joback Calculated Property |
| Cp,gas | 269.40 | J/mol×K | 871.60 | Joback Calculated Property |
| Cp,gas | 273.46 | J/mol×K | 911.01 | Joback Calculated Property |
| η | [0.0000890; 0.0011214] | Pa×s | [450.46; 674.57] |
|
| η | 0.0011214 | Pa×s | 450.46 | Joback Calculated Property |
| η | 0.0006253 | Pa×s | 487.81 | Joback Calculated Property |
| η | 0.0003789 | Pa×s | 525.16 | Joback Calculated Property |
| η | 0.0002454 | Pa×s | 562.51 | Joback Calculated Property |
| η | 0.0001678 | Pa×s | 599.87 | Joback Calculated Property |
| η | 0.0001199 | Pa×s | 637.22 | Joback Calculated Property |
| η | 0.0000890 | Pa×s | 674.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,5-Dibromobenzoic acid.
Sources
- Crippen Method
- Crippen Method
- Vapor pressures, standard molar enthalpies, entropies Gibbs energies of sublimation and heat capacities of 2,5- and 3,5-dibromobenzoic acids
- Joback Method
- McGowan Method
- NIST Webbook
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