- InChI
- InChI=1S/C3H4BrClO2/c1-3(4,5)2(6)7/h1H3,(H,6,7)
- InChI Key
- DQCULHMEDFODNL-UHFFFAOYSA-N
- Formula
- C3H4BrClO2
- SMILES
- CC(Cl)(Br)C(=O)O
- Molecular Weight1
- 187.42
- CAS
- 92018-32-1
- 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).
- 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 | 0.5721 | Relay (1.0) Calculated Property | |
| ΔfG° | -286.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -435.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.421 | Crippen Calculated Property | |
| McVol | 90.310 | ml/mol | McGowan Calculated Property |
| Pc | 5917.16 | kPa | Joback Calculated Property |
| Tboil | 477.82 | K | Relay (1.0) Calculated Property |
| Tc | 699.61 | K | Relay (1.0) Calculated Property |
| Tfus | 332.19 | K | Relay (1.0) Calculated Property |
| Vc | 0.327 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [158.30; 182.37] | J/mol×K | [514.45; 723.90] | 
|
| Cp,gas | 158.30 | J/mol×K | 514.45 | Joback Calculated Property |
| Cp,gas | 163.31 | J/mol×K | 549.36 | Joback Calculated Property |
| Cp,gas | 167.88 | J/mol×K | 584.27 | Joback Calculated Property |
| Cp,gas | 172.03 | J/mol×K | 619.18 | Joback Calculated Property |
| Cp,gas | 175.80 | J/mol×K | 654.09 | Joback Calculated Property |
| Cp,gas | 179.24 | J/mol×K | 688.99 | Joback Calculated Property |
| Cp,gas | 182.37 | J/mol×K | 723.90 | Joback Calculated Property |
| η | [0.0002456; 0.0093909] | Pa×s | [326.46; 514.45] |
|
| η | 0.0093909 | Pa×s | 326.46 | Joback Calculated Property |
| η | 0.0039217 | Pa×s | 357.79 | Joback Calculated Property |
| η | 0.0018850 | Pa×s | 389.12 | Joback Calculated Property |
| η | 0.0010106 | Pa×s | 420.46 | Joback Calculated Property |
| η | 0.0005907 | Pa×s | 451.79 | Joback Calculated Property |
| η | 0.0003702 | Pa×s | 483.12 | Joback Calculated Property |
| η | 0.0002456 | Pa×s | 514.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Alpha-bromo alpha-chloro-propionic acid.
Sources
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