- InChI
- InChI=1S/C6H10Br2O2/c1-6(2,3)10-5(9)4(7)8/h4H,1-3H3
- InChI Key
- WVNZGIJOOOHIPU-UHFFFAOYSA-N
- Formula
- C6H10Br2O2
- SMILES
- CC(C)(C)OC(=O)C(Br)Br
- Molecular Weight1
- 273.95
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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.
- I : 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 |
|---|---|---|---|
| ω | 0.5224 | Relay (1.0) Calculated Property | |
| ΔfG° | -205.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -443.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.47 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.444 | Crippen Calculated Property | |
| McVol | 137.840 | ml/mol | McGowan Calculated Property |
| Pc | 3990.60 | kPa | Joback Calculated Property |
| Inp | [1103.00; 1103.00] |
|
|
| Inp | 1103.00 | NIST | |
| Inp | 1103.00 | NIST | |
| I | 1564.00 | NIST | |
| Tboil | 472.67 | K | Relay (1.0) Calculated Property |
| Tc | 664.15 | K | Relay (1.0) Calculated Property |
| Tfus | 300.66 | K | Relay (1.0) Calculated Property |
| Vc | 0.490 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [272.30; 323.40] | J/mol×K | [541.62; 769.22] |
|
| Cp,gas | 272.30 | J/mol×K | 541.62 | Joback Calculated Property |
| Cp,gas | 282.50 | J/mol×K | 579.55 | Joback Calculated Property |
| Cp,gas | 291.97 | J/mol×K | 617.49 | Joback Calculated Property |
| Cp,gas | 300.75 | J/mol×K | 655.42 | Joback Calculated Property |
| Cp,gas | 308.88 | J/mol×K | 693.36 | Joback Calculated Property |
| Cp,gas | 316.42 | J/mol×K | 731.29 | Joback Calculated Property |
| Cp,gas | 323.40 | J/mol×K | 769.22 | Joback Calculated Property |
| η | [0.0002740; 0.0028816] | Pa×s | [336.56; 541.62] |
|
| η | 0.0028816 | Pa×s | 336.56 | Joback Calculated Property |
| η | 0.0016249 | Pa×s | 370.74 | Joback Calculated Property |
| η | 0.0010093 | Pa×s | 404.91 | Joback Calculated Property |
| η | 0.0006752 | Pa×s | 439.09 | Joback Calculated Property |
| η | 0.0004786 | Pa×s | 473.27 | Joback Calculated Property |
| η | 0.0003554 | Pa×s | 507.44 | Joback Calculated Property |
| η | 0.0002740 | Pa×s | 541.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetic acid, dibromo, 1,1-dimethylethyl ester.
Sources
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