- InChI
- InChI=1S/C6H7Br3O2/c1-2-3-4-11-5(10)6(7,8)9/h2H,1,3-4H2
- InChI Key
- OXFDEYLWHBTVJU-UHFFFAOYSA-N
- Formula
- C6H7Br3O2
- SMILES
- C=CCCOC(=O)C(Br)(Br)Br
- Molecular Weight1
- 350.83
- 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° | -100.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -216.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.44 | kJ/mol | Joback Calculated Property |
| log10WS | -3.45 | Crippen Calculated Property | |
| logPoct/wat | 2.944 | Crippen Calculated Property | |
| McVol | 151.040 | ml/mol | McGowan Calculated Property |
| Pc | 4565.38 | kPa | Joback Calculated Property |
| Inp | 1405.00 | NIST | |
| Tboil | 604.90 | K | Joback Calculated Property |
| Tc | 846.04 | K | Joback Calculated Property |
| Tfus | 409.60 | K | Joback Calculated Property |
| Vc | 0.551 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [281.37; 319.55] | J/mol×K | [604.90; 846.04] | 
|
| Cp,gas | 281.37 | J/mol×K | 604.90 | Joback Calculated Property |
| Cp,gas | 289.25 | J/mol×K | 645.09 | Joback Calculated Property |
| Cp,gas | 296.42 | J/mol×K | 685.28 | Joback Calculated Property |
| Cp,gas | 302.97 | J/mol×K | 725.47 | Joback Calculated Property |
| Cp,gas | 308.96 | J/mol×K | 765.66 | Joback Calculated Property |
| Cp,gas | 314.46 | J/mol×K | 805.85 | Joback Calculated Property |
| Cp,gas | 319.55 | J/mol×K | 846.04 | Joback Calculated Property |
| η | [0.0002472; 0.0014834] | Pa×s | [409.60; 604.90] |
|
| η | 0.0014834 | Pa×s | 409.60 | Joback Calculated Property |
| η | 0.0009859 | Pa×s | 442.15 | Joback Calculated Property |
| η | 0.0006929 | Pa×s | 474.70 | Joback Calculated Property |
| η | 0.0005096 | Pa×s | 507.25 | Joback Calculated Property |
| η | 0.0003889 | Pa×s | 539.80 | Joback Calculated Property |
| η | 0.0003061 | Pa×s | 572.35 | Joback Calculated Property |
| η | 0.0002472 | Pa×s | 604.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Buten-1-ol, tribromoacetate.
Sources
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