- InChI
- InChI=1S/C8H14Br2O2/c1-6(2)3-4-12-8(11)7(10)5-9/h6-7H,3-5H2,1-2H3
- InChI Key
- JMGSCPGYIYOURH-UHFFFAOYSA-N
- Formula
- C8H14Br2O2
- SMILES
- CC(C)CCOC(=O)C(Br)CBr
- Molecular Weight1
- 302.00
- 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° | -193.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -411.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.65 | kJ/mol | Joback Calculated Property |
| log10WS | -2.77 | Crippen Calculated Property | |
| logPoct/wat | 2.734 | Crippen Calculated Property | |
| McVol | 166.020 | ml/mol | McGowan Calculated Property |
| Pc | 3135.00 | kPa | Joback Calculated Property |
| Inp | 1383.00 | NIST | |
| Tboil | 590.17 | K | Joback Calculated Property |
| Tc | 801.33 | K | Joback Calculated Property |
| Tfus | 341.68 | K | Joback Calculated Property |
| Vc | 0.620 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [358.39; 419.43] | J/mol×K | [590.17; 801.33] | 
|
| Cp,gas | 358.39 | J/mol×K | 590.17 | Joback Calculated Property |
| Cp,gas | 370.14 | J/mol×K | 625.36 | Joback Calculated Property |
| Cp,gas | 381.23 | J/mol×K | 660.56 | Joback Calculated Property |
| Cp,gas | 391.68 | J/mol×K | 695.75 | Joback Calculated Property |
| Cp,gas | 401.52 | J/mol×K | 730.94 | Joback Calculated Property |
| Cp,gas | 410.76 | J/mol×K | 766.13 | Joback Calculated Property |
| Cp,gas | 419.43 | J/mol×K | 801.33 | Joback Calculated Property |
| η | [0.0002150; 0.0027803] | Pa×s | [341.68; 590.17] |
|
| η | 0.0027803 | Pa×s | 341.68 | Joback Calculated Property |
| η | 0.0014410 | Pa×s | 383.10 | Joback Calculated Property |
| η | 0.0008491 | Pa×s | 424.51 | Joback Calculated Property |
| η | 0.0005496 | Pa×s | 465.92 | Joback Calculated Property |
| η | 0.0003819 | Pa×s | 507.34 | Joback Calculated Property |
| η | 0.0002804 | Pa×s | 548.75 | Joback Calculated Property |
| η | 0.0002150 | Pa×s | 590.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 2,3-dibromo, 3-methylbutyl ester.
Sources
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