- InChI
- InChI=1S/C3H3Br/c1-2-3-4/h3H,1H2
- InChI Key
- UUIORUQWCRSGJS-UHFFFAOYSA-N
- Formula
- C3H3Br
- SMILES
- C=C=CBr
- Molecular Weight1
- 118.96
- CAS
- 10024-18-7
- Other Names
-
- Propa-1,2-diene, 1-bromo-
- 1-Bromopropadiene
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 |
|---|---|---|---|
| ΔfG° | 204.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 209.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 28.47 | kJ/mol | Joback Calculated Property |
| IE | 9.46 | eV | NIST |
| log10WS | -1.73 | Crippen Calculated Property | |
| logPoct/wat | 1.680 | Crippen Calculated Property | |
| McVol | 62.030 | ml/mol | McGowan Calculated Property |
| Pc | 5889.94 | kPa | Joback Calculated Property |
| Tboil | 334.15 | K | Joback Calculated Property |
| Tc | 538.01 | K | Joback Calculated Property |
| Tfus | 188.12 | K | Joback Calculated Property |
| Vc | 0.227 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [77.67; 97.26] | J/mol×K | [334.15; 538.01] | 
|
| Cp,gas | 77.67 | J/mol×K | 334.15 | Joback Calculated Property |
| Cp,gas | 81.29 | J/mol×K | 368.13 | Joback Calculated Property |
| Cp,gas | 84.76 | J/mol×K | 402.10 | Joback Calculated Property |
| Cp,gas | 88.09 | J/mol×K | 436.08 | Joback Calculated Property |
| Cp,gas | 91.28 | J/mol×K | 470.05 | Joback Calculated Property |
| Cp,gas | 94.34 | J/mol×K | 504.03 | Joback Calculated Property |
| Cp,gas | 97.26 | J/mol×K | 538.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Propadiene, 1-bromo-.
Sources
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