- InChI
- InChI=1S/C3H4Br2O/c1-2(4)3(5)6/h2H,1H3
- InChI Key
- ILLHORFDXDLILE-UHFFFAOYSA-N
- Formula
- C3H4Br2O
- SMILES
- CC(Br)C(=O)Br
- Molecular Weight1
- 215.87
- CAS
- 563-76-8
- Other Names
-
- «alpha»-Bromopropionyl bromide
- Propanoyl bromide, 2-bromo-
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.4305 | Relay (1.0) Calculated Property | |
| ΔfG° | -128.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -192.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.691 | Crippen Calculated Property | |
| McVol | 89.700 | ml/mol | McGowan Calculated Property |
| Pc | 5944.56 | kPa | Joback Calculated Property |
| Tboil | 426.20 | K | NIST |
| Tc | 633.21 | K | Relay (1.0) Calculated Property |
| Tfus | 294.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.321 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [130.78; 158.43] | J/mol×K | [453.79; 680.62] | 
|
| Cp,gas | 130.78 | J/mol×K | 453.79 | Joback Calculated Property |
| Cp,gas | 136.32 | J/mol×K | 491.60 | Joback Calculated Property |
| Cp,gas | 141.46 | J/mol×K | 529.40 | Joback Calculated Property |
| Cp,gas | 146.21 | J/mol×K | 567.21 | Joback Calculated Property |
| Cp,gas | 150.61 | J/mol×K | 605.01 | Joback Calculated Property |
| Cp,gas | 154.67 | J/mol×K | 642.82 | Joback Calculated Property |
| Cp,gas | 158.43 | J/mol×K | 680.62 | Joback Calculated Property |
| η | [0.0005016; 0.0037576] | Pa×s | [278.10; 453.79] |
|
| η | 0.0037576 | Pa×s | 278.10 | Joback Calculated Property |
| η | 0.0022894 | Pa×s | 307.38 | Joback Calculated Property |
| η | 0.0015204 | Pa×s | 336.66 | Joback Calculated Property |
| η | 0.0010781 | Pa×s | 365.95 | Joback Calculated Property |
| η | 0.0008044 | Pa×s | 395.23 | Joback Calculated Property |
| η | 0.0006249 | Pa×s | 424.51 | Joback Calculated Property |
| η | 0.0005016 | Pa×s | 453.79 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 322.20 | K | 1.30 | NIST |
Similar Compounds
Find more compounds similar to 2-Bromopropionyl bromide.
Sources
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