- InChI
- InChI=1S/C4H5BrO2/c1-7-4(6)2-3-5/h2-3H,1H3/b3-2-
- InChI Key
- HGOGNLOBEAIJAM-IHWYPQMZSA-N
- Formula
- C4H5BrO2
- SMILES
- COC(=O)C=CBr
- Molecular Weight1
- 164.99
- CAS
- 6214-22-8
- Other Names
-
- Methyl (2Z)-3-bromo-2-propenoate
- 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).
- 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° | -156.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -227.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.05 | kJ/mol | Joback Calculated Property |
| log10WS | -1.14 | Crippen Calculated Property | |
| logPoct/wat | 1.068 | Crippen Calculated Property | |
| McVol | 87.860 | ml/mol | McGowan Calculated Property |
| Pc | 4856.20 | kPa | Joback Calculated Property |
| Tboil | 437.53 | K | Joback Calculated Property |
| Tc | 646.70 | K | Joback Calculated Property |
| Tfus | 261.72 | K | Joback Calculated Property |
| Vc | 0.326 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [142.16; 175.90] | J/mol×K | [437.53; 646.70] | 
|
| Cp,gas | 142.16 | J/mol×K | 437.53 | Joback Calculated Property |
| Cp,gas | 148.61 | J/mol×K | 472.39 | Joback Calculated Property |
| Cp,gas | 154.70 | J/mol×K | 507.25 | Joback Calculated Property |
| Cp,gas | 160.47 | J/mol×K | 542.12 | Joback Calculated Property |
| Cp,gas | 165.91 | J/mol×K | 576.98 | Joback Calculated Property |
| Cp,gas | 171.05 | J/mol×K | 611.84 | Joback Calculated Property |
| Cp,gas | 175.90 | J/mol×K | 646.70 | Joback Calculated Property |
| η | [0.0003145; 0.0023734] | Pa×s | [261.72; 437.53] |
|
| η | 0.0023734 | Pa×s | 261.72 | Joback Calculated Property |
| η | 0.0014304 | Pa×s | 291.02 | Joback Calculated Property |
| η | 0.0009457 | Pa×s | 320.32 | Joback Calculated Property |
| η | 0.0006701 | Pa×s | 349.62 | Joback Calculated Property |
| η | 0.0005009 | Pa×s | 378.93 | Joback Calculated Property |
| η | 0.0003903 | Pa×s | 408.23 | Joback Calculated Property |
| η | 0.0003145 | Pa×s | 437.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propenoic acid, 3-bromo-, methyl ester, (Z)-.
Sources
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