- InChI
- InChI=1S/C6H10Br2O2/c1-2-3-10-6(9)5(8)4-7/h5H,2-4H2,1H3
- InChI Key
- BQCHXTFYXMLUBX-UHFFFAOYSA-N
- Formula
- C6H10Br2O2
- SMILES
- CCCOC(=O)C(Br)CBr
- Molecular Weight1
- 273.95
- CAS
- 79762-76-8
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -208.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -364.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.59 | kJ/mol | Joback Calculated Property |
| log10WS | -2.17 | Crippen Calculated Property | |
| logPoct/wat | 2.098 | Crippen Calculated Property | |
| McVol | 137.840 | ml/mol | McGowan Calculated Property |
| Pc | 3896.50 | kPa | Joback Calculated Property |
| Inp | [1234.00; 1234.00] |
|
|
| Inp | 1234.00 | NIST | |
| Inp | 1234.00 | NIST | |
| Tboil | 544.85 | K | Joback Calculated Property |
| Tc | 758.56 | K | Joback Calculated Property |
| Tfus | 334.14 | K | Joback Calculated Property |
| Vc | 0.513 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.48; 317.98] | J/mol×K | [544.85; 758.56] |
|
| Cp,gas | 268.48 | J/mol×K | 544.85 | Joback Calculated Property |
| Cp,gas | 277.99 | J/mol×K | 580.47 | Joback Calculated Property |
| Cp,gas | 286.97 | J/mol×K | 616.09 | Joback Calculated Property |
| Cp,gas | 295.44 | J/mol×K | 651.70 | Joback Calculated Property |
| Cp,gas | 303.42 | J/mol×K | 687.32 | Joback Calculated Property |
| Cp,gas | 310.93 | J/mol×K | 722.94 | Joback Calculated Property |
| Cp,gas | 317.98 | J/mol×K | 758.56 | Joback Calculated Property |
| η | [0.0002938; 0.0025030] | Pa×s | [334.14; 544.85] |
|
| η | 0.0025030 | Pa×s | 334.14 | Joback Calculated Property |
| η | 0.0014779 | Pa×s | 369.26 | Joback Calculated Property |
| η | 0.0009563 | Pa×s | 404.38 | Joback Calculated Property |
| η | 0.0006633 | Pa×s | 439.50 | Joback Calculated Property |
| η | 0.0004857 | Pa×s | 474.61 | Joback Calculated Property |
| η | 0.0003713 | Pa×s | 509.73 | Joback Calculated Property |
| η | 0.0002938 | Pa×s | 544.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 2,3-dibromo-, propyl ester.
Sources
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