- InChI
- InChI=1S/C6H11Br/c1-2-3-4-5-6-7/h2H,1,3-6H2
- InChI Key
- RIMXEJYJXDBLIE-UHFFFAOYSA-N
- Formula
- C6H11Br
- SMILES
- C=CCCCCBr
- Molecular Weight1
- 163.06
- CAS
- 2695-47-8
- Other Names
-
- 1-Bromo-5-hexene
- 5-Hexen-1-yl bromide
- 5-Hexenyl bromide
- 6-Bromohexene
- 6-bromohex-1-ene
- 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).
- Pvap : Vapor 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 | 0.4017 | Relay (1.0) Calculated Property | |
| ΔfG° | 101.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -23.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.738 | Crippen Calculated Property | |
| McVol | 108.600 | ml/mol | McGowan Calculated Property |
| Pc | 3530.46 | kPa | Joback Calculated Property |
| Tboil | 422.41 | K | Relay (1.0) Calculated Property |
| Tc | 612.81 | K | Relay (1.0) Calculated Property |
| Tfus | 186.62 | K | Relay (1.0) Calculated Property |
| Vc | 0.396 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 322.20 | K | 2.10 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [136.94; 309.43] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 2.63400e+00 | |||
| Coefficient B | 5.92000e-01 | |||
| Coefficient C | -3.96900e-04 | |||
| Coefficient D | 1.11700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 136.94 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 167.34 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 194.11 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 217.59 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 238.16 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 256.14 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 271.91 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 285.81 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 298.20 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 309.43 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0035539; 0.0003158] | Pa×s | [215.42; 411.26] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.07229e+01 | |||
| Coefficient B | 1.09502e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 215.42 | |||
| Temperature range, max. | 411.26 | |||
| η | 0.0035539 | Pa×s | 215.42 | Calculated Property |
| η | 0.0022293 | Pa×s | 237.18 | Calculated Property |
| η | 0.0015124 | Pa×s | 258.94 | Calculated Property |
| η | 0.0010897 | Pa×s | 280.70 | Calculated Property |
| η | 0.0008230 | Pa×s | 302.46 | Calculated Property |
| η | 0.0006455 | Pa×s | 324.22 | Calculated Property |
| η | 0.0005219 | Pa×s | 345.98 | Calculated Property |
| η | 0.0004328 | Pa×s | 367.74 | Calculated Property |
| η | 0.0003665 | Pa×s | 389.50 | Calculated Property |
| η | 0.0003158 | Pa×s | 411.26 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [314.52; 473.30] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.34468e+01 | |||
| Coefficient B | -3.38355e+03 | |||
| Coefficient C | -5.73960e+01 | |||
| Temperature range, min. | 314.52 | |||
| Temperature range, max. | 473.30 | |||
| Pvap | 1.33 | kPa | 314.52 | Calculated Property |
| Pvap | 3.10 | kPa | 332.16 | Calculated Property |
| Pvap | 6.52 | kPa | 349.80 | Calculated Property |
| Pvap | 12.60 | kPa | 367.45 | Calculated Property |
| Pvap | 22.68 | kPa | 385.09 | Calculated Property |
| Pvap | 38.43 | kPa | 402.73 | Calculated Property |
| Pvap | 61.88 | kPa | 420.37 | Calculated Property |
| Pvap | 95.32 | kPa | 438.02 | Calculated Property |
| Pvap | 141.32 | kPa | 455.66 | Calculated Property |
| Pvap | 202.63 | kPa | 473.30 | Calculated Property |
Similar Compounds
Find more compounds similar to 6-BROMO-1-HEXENE.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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