- InChI
- InChI=1S/C7H10Br2O2/c1-2-3-4-5-11-7(10)6(8)9/h2,6H,1,3-5H2
- InChI Key
- RGOUCZGJJDKQPF-UHFFFAOYSA-N
- Formula
- C7H10Br2O2
- SMILES
- C=CCCCOC(=O)C(Br)Br
- Molecular Weight1
- 285.96
- 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 | 0.5870 | Relay (1.0) Calculated Property | |
| ΔfG° | -111.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -331.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.612 | Crippen Calculated Property | |
| McVol | 147.630 | ml/mol | McGowan Calculated Property |
| Pc | 3646.53 | kPa | Joback Calculated Property |
| Inp | 1318.00 | NIST | |
| I | 1928.00 | NIST | |
| Tboil | 513.57 | K | Relay (1.0) Calculated Property |
| Tc | 708.82 | K | Relay (1.0) Calculated Property |
| Tfus | 258.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.502 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [292.83; 343.28] | J/mol×K | [564.41; 779.02] | 
|
| Cp,gas | 292.83 | J/mol×K | 564.41 | Joback Calculated Property |
| Cp,gas | 302.61 | J/mol×K | 600.18 | Joback Calculated Property |
| Cp,gas | 311.81 | J/mol×K | 635.95 | Joback Calculated Property |
| Cp,gas | 320.45 | J/mol×K | 671.72 | Joback Calculated Property |
| Cp,gas | 328.56 | J/mol×K | 707.48 | Joback Calculated Property |
| Cp,gas | 336.16 | J/mol×K | 743.25 | Joback Calculated Property |
| Cp,gas | 343.28 | J/mol×K | 779.02 | Joback Calculated Property |
| η | [0.0002697; 0.0022921] | Pa×s | [343.65; 564.41] |
|
| η | 0.0022921 | Pa×s | 343.65 | Joback Calculated Property |
| η | 0.0013504 | Pa×s | 380.44 | Joback Calculated Property |
| η | 0.0008734 | Pa×s | 417.24 | Joback Calculated Property |
| η | 0.0006062 | Pa×s | 454.03 | Joback Calculated Property |
| η | 0.0004444 | Pa×s | 490.82 | Joback Calculated Property |
| η | 0.0003402 | Pa×s | 527.62 | Joback Calculated Property |
| η | 0.0002697 | Pa×s | 564.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Penten-1-ol, dibromoacetate.
Sources
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