- InChI
- InChI=1S/C9H9Br/c10-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2/b7-4+
- InChI Key
- RUROFEVDCUGKHD-QPJJXVBHSA-N
- Formula
- C9H9Br
- SMILES
- BrCC=Cc1ccccc1
- Molecular Weight1
- 197.07
- CAS
- 4392-24-9
- Other Names
-
- 3-Bromo-1-phenyl propene-1
- Cinnamyl bromide
- [3-Bromo-1-propenyl]benzene
- 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 | 0.3949 | Relay (1.0) Calculated Property | |
| ΔfG° | 231.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 143.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.095 | Crippen Calculated Property | |
| McVol | 127.110 | ml/mol | McGowan Calculated Property |
| Pc | 3763.78 | kPa | Joback Calculated Property |
| Tboil | 519.90 | K | Relay (1.0) Calculated Property |
| Tc | 729.26 | K | Relay (1.0) Calculated Property |
| Tfus | 297.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.438 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [236.96; 299.70] | J/mol×K | [502.32; 738.17] | 
|
| Cp,gas | 236.96 | J/mol×K | 502.32 | Joback Calculated Property |
| Cp,gas | 249.66 | J/mol×K | 541.63 | Joback Calculated Property |
| Cp,gas | 261.36 | J/mol×K | 580.94 | Joback Calculated Property |
| Cp,gas | 272.15 | J/mol×K | 620.24 | Joback Calculated Property |
| Cp,gas | 282.08 | J/mol×K | 659.55 | Joback Calculated Property |
| Cp,gas | 291.24 | J/mol×K | 698.86 | Joback Calculated Property |
| Cp,gas | 299.70 | J/mol×K | 738.17 | Joback Calculated Property |
| η | [0.0002373; 0.0027272] | Pa×s | [272.33; 502.32] |
|
| η | 0.0027272 | Pa×s | 272.33 | Joback Calculated Property |
| η | 0.0014124 | Pa×s | 310.66 | Joback Calculated Property |
| η | 0.0008452 | Pa×s | 348.99 | Joback Calculated Property |
| η | 0.0005599 | Pa×s | 387.33 | Joback Calculated Property |
| η | 0.0003994 | Pa×s | 425.66 | Joback Calculated Property |
| η | 0.0003013 | Pa×s | 463.99 | Joback Calculated Property |
| η | 0.0002373 | Pa×s | 502.32 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 376.20 | K | 2.90 | NIST |
Similar Compounds
Find more compounds similar to 3-Bromo-1-phenyl-1-propene.
Sources
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