- InChI
- InChI=1S/C6H12Br2/c1-5(7)3-4-6(2)8/h5-6H,3-4H2,1-2H3
- InChI Key
- MQYLGFBWOZXHHF-UHFFFAOYSA-N
- Formula
- C6H12Br2
- SMILES
- CC(Br)CCC(C)Br
- Molecular Weight1
- 243.97
- CAS
- 24774-58-1
- Other Names
-
- 2,5-Dibromohexane
- 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).
- 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 | 0.4687 | Relay (1.0) Calculated Property | |
| ΔfG° | 23.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -163.17 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.333 | Crippen Calculated Property | |
| McVol | 130.400 | ml/mol | McGowan Calculated Property |
| Pc | 3718.02 | kPa | Joback Calculated Property |
| Tboil | 481.15 ± 5.00 | K | NIST |
| Tc | 661.32 | K | Relay (1.0) Calculated Property |
| Tfus | 311.15 ± 2.00 | K | NIST |
| Vc | 0.464 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.43; 291.59] | J/mol×K | [468.12; 679.14] | 
|
| Cp,gas | 234.43 | J/mol×K | 468.12 | Joback Calculated Property |
| Cp,gas | 245.45 | J/mol×K | 503.29 | Joback Calculated Property |
| Cp,gas | 255.83 | J/mol×K | 538.46 | Joback Calculated Property |
| Cp,gas | 265.60 | J/mol×K | 573.63 | Joback Calculated Property |
| Cp,gas | 274.79 | J/mol×K | 608.80 | Joback Calculated Property |
| Cp,gas | 283.45 | J/mol×K | 643.97 | Joback Calculated Property |
| Cp,gas | 291.59 | J/mol×K | 679.14 | Joback Calculated Property |
| η | [0.0003373; 0.0061816] | Pa×s | [246.98; 468.12] |
|
| η | 0.0061816 | Pa×s | 246.98 | Joback Calculated Property |
| η | 0.0027790 | Pa×s | 283.84 | Joback Calculated Property |
| η | 0.0015014 | Pa×s | 320.69 | Joback Calculated Property |
| η | 0.0009209 | Pa×s | 357.55 | Joback Calculated Property |
| η | 0.0006189 | Pa×s | 394.41 | Joback Calculated Property |
| η | 0.0004452 | Pa×s | 431.26 | Joback Calculated Property |
| η | 0.0003373 | Pa×s | 468.12 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [364.92; 508.99] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.54241e+01 | |||
| Coefficient B | -4.38975e+03 | |||
| Coefficient C | -7.49100e+01 | |||
| Temperature range, min. | 364.92 | |||
| Temperature range, max. | 508.99 | |||
| Pvap | 1.33 | kPa | 364.92 | Calculated Property |
| Pvap | 2.94 | kPa | 380.93 | Calculated Property |
| Pvap | 6.00 | kPa | 396.94 | Calculated Property |
| Pvap | 11.45 | kPa | 412.94 | Calculated Property |
| Pvap | 20.60 | kPa | 428.95 | Calculated Property |
| Pvap | 35.22 | kPa | 444.96 | Calculated Property |
| Pvap | 57.59 | kPa | 460.97 | Calculated Property |
| Pvap | 90.57 | kPa | 476.97 | Calculated Property |
| Pvap | 137.57 | kPa | 492.98 | Calculated Property |
| Pvap | 202.63 | kPa | 508.99 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexane, 2,5-dibromo-.
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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