- InChI
- InChI=1S/C3H5BrO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)
- InChI Key
- MONMFXREYOKQTI-UHFFFAOYSA-N
- Formula
- C3H5BrO2
- SMILES
- CC(Br)C(=O)O
- Molecular Weight1
- 152.97
- CAS
- 10327-08-9
- 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).
- Tboilr : Boiling point at reduced pressure (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° | -279.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -349.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.74 | kJ/mol | Joback Calculated Property |
| log10WS | -0.72 | Crippen Calculated Property | |
| logPoct/wat | 0.854 | Crippen Calculated Property | |
| McVol | 78.070 | ml/mol | McGowan Calculated Property |
| Pc | 6161.14 | kPa | Joback Calculated Property |
| Tboil | 476.70 | K | NIST |
| Tc | 675.66 | K | Joback Calculated Property |
| Tfus | 279.12 | K | Joback Calculated Property |
| Vc | 0.284 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [136.48; 163.43] | J/mol×K | [479.81; 675.66] | 
|
| Cp,gas | 136.48 | J/mol×K | 479.81 | Joback Calculated Property |
| Cp,gas | 141.65 | J/mol×K | 512.45 | Joback Calculated Property |
| Cp,gas | 146.53 | J/mol×K | 545.09 | Joback Calculated Property |
| Cp,gas | 151.14 | J/mol×K | 577.73 | Joback Calculated Property |
| Cp,gas | 155.49 | J/mol×K | 610.37 | Joback Calculated Property |
| Cp,gas | 159.58 | J/mol×K | 643.02 | Joback Calculated Property |
| Cp,gas | 163.43 | J/mol×K | 675.66 | Joback Calculated Property |
| η | [0.0002906; 0.0217983] | Pa×s | [279.12; 479.81] |
|
| η | 0.0217983 | Pa×s | 279.12 | Joback Calculated Property |
| η | 0.0072223 | Pa×s | 312.57 | Joback Calculated Property |
| η | 0.0029627 | Pa×s | 346.02 | Joback Calculated Property |
| η | 0.0014220 | Pa×s | 379.47 | Joback Calculated Property |
| η | 0.0007687 | Pa×s | 412.91 | Joback Calculated Property |
| η | 0.0004557 | Pa×s | 446.36 | Joback Calculated Property |
| η | 0.0002906 | Pa×s | 479.81 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 369.20 | K | 1.30 | NIST |
Similar Compounds
Find more compounds similar to Propanoic acid, 2-bromo-, (.+/-.)-.
Sources
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