- InChI
- InChI=1S/C6H10Br2O2/c1-4(2)10-6(9)5(8)3-7/h4-5H,3H2,1-2H3
- InChI Key
- BBPMOKKLDQBRLS-UHFFFAOYSA-N
- Formula
- C6H10Br2O2
- SMILES
- CC(C)OC(=O)C(Br)CBr
- Molecular Weight1
- 273.95
- 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° | -210.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -369.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.20 | kJ/mol | Joback Calculated Property |
| log10WS | -2.28 | Crippen Calculated Property | |
| logPoct/wat | 2.096 | Crippen Calculated Property | |
| McVol | 137.840 | ml/mol | McGowan Calculated Property |
| Pc | 3935.71 | kPa | Joback Calculated Property |
| Inp | [1174.00; 1174.00] |
|
|
| Inp | 1174.00 | NIST | |
| Inp | 1174.00 | NIST | |
| Tboil | 544.41 | K | Joback Calculated Property |
| Tc | 762.87 | K | Joback Calculated Property |
| Tfus | 319.14 | K | Joback Calculated Property |
| Vc | 0.507 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.87; 319.55] | J/mol×K | [544.41; 762.87] |
|
| Cp,gas | 268.87 | J/mol×K | 544.41 | Joback Calculated Property |
| Cp,gas | 278.66 | J/mol×K | 580.82 | Joback Calculated Property |
| Cp,gas | 287.88 | J/mol×K | 617.23 | Joback Calculated Property |
| Cp,gas | 296.57 | J/mol×K | 653.64 | Joback Calculated Property |
| Cp,gas | 304.73 | J/mol×K | 690.05 | Joback Calculated Property |
| Cp,gas | 312.38 | J/mol×K | 726.46 | Joback Calculated Property |
| Cp,gas | 319.55 | J/mol×K | 762.87 | Joback Calculated Property |
| η | [0.0002762; 0.0031975] | Pa×s | [319.14; 544.41] |
|
| η | 0.0031975 | Pa×s | 319.14 | Joback Calculated Property |
| η | 0.0017149 | Pa×s | 356.69 | Joback Calculated Property |
| η | 0.0010356 | Pa×s | 394.23 | Joback Calculated Property |
| η | 0.0006828 | Pa×s | 431.77 | Joback Calculated Property |
| η | 0.0004812 | Pa×s | 469.32 | Joback Calculated Property |
| η | 0.0003571 | Pa×s | 506.86 | Joback Calculated Property |
| η | 0.0002762 | Pa×s | 544.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isopropyl 2,3-dibromopropanoate.
Sources
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