- InChI
- InChI=1S/C8H11Br3O2/c1-2-3-4-5-6-13-7(12)8(9,10)11/h3-4H,2,5-6H2,1H3/b4-3+
- InChI Key
- XQAGGAGAPPBDDP-ONEGZZNKSA-N
- Formula
- C8H11Br3O2
- SMILES
- CCC=CCCOC(=O)C(Br)(Br)Br
- Molecular Weight1
- 378.88
- 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.
- 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 | 0.6009 | Relay (... Calculated Property | |
| ΔfG° | -91.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -298.25 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 27.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.52 | kJ/mol | Relay (... Calculated Property |
| IE | 9.55 | eV | Relay (... Calculated Property |
| log10WS | -4.68 | Relay (... Calculated Property | |
| logPoct/wat | 3.724 | Crippen Calculated Property | |
| McVol | 179.220 | ml/mol | McGowan Calculated Property |
| Pc | 3620.24 | kPa | Joback Calculated Property |
| Inp | 1623.00 | NIST | |
| Tboil | 545.03 | K | Relay (... Calculated Property |
| Tc | 724.97 | K | Relay (... Calculated Property |
| Tfus | 230.25 | K | Relay (... Calculated Property |
| Vc | 0.609 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [371.86; 420.69] | J/mol×K | [658.14; 894.37] | 
|
| Cp,gas | 371.86 | J/mol×K | 658.14 | Joback Calculated Property |
| Cp,gas | 381.61 | J/mol×K | 697.51 | Joback Calculated Property |
| Cp,gas | 390.59 | J/mol×K | 736.88 | Joback Calculated Property |
| Cp,gas | 398.91 | J/mol×K | 776.26 | Joback Calculated Property |
| Cp,gas | 406.63 | J/mol×K | 815.63 | Joback Calculated Property |
| Cp,gas | 413.87 | J/mol×K | 855.00 | Joback Calculated Property |
| Cp,gas | 420.69 | J/mol×K | 894.37 | Joback Calculated Property |
| η | [0.0001501; 0.0011471] | Pa×s | [428.82; 658.14] |
|
| η | 0.0011471 | Pa×s | 428.82 | Joback Calculated Property |
| η | 0.0007114 | Pa×s | 467.04 | Joback Calculated Property |
| η | 0.0004743 | Pa×s | 505.26 | Joback Calculated Property |
| η | 0.0003348 | Pa×s | 543.48 | Joback Calculated Property |
| η | 0.0002474 | Pa×s | 581.70 | Joback Calculated Property |
| η | 0.0001897 | Pa×s | 619.92 | Joback Calculated Property |
| η | 0.0001501 | Pa×s | 658.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-3-Hexen-1-ol, tribromoacetate.
Sources
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