- InChI
- InChI=1S/C6H12Br2/c1-3-4-6(8)5(2)7/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1
- InChI Key
- CHNCACSQVNDLSU-WDSKDSINSA-N
- Formula
- C6H12Br2
- SMILES
- CCCC(Br)C(C)Br
- Molecular Weight1
- 243.97
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.4394 | Relay (1.0) Calculated Property | |
| ΔfG° | 23.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -131.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.69 | 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 |
| Inp | 1102.00 | NIST | |
| Tboil | 456.41 | K | Relay (1.0) Calculated Property |
| Tc | 663.07 | K | Relay (1.0) Calculated Property |
| Tfus | 249.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.465 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.49; 291.66] | J/mol×K | [468.32; 679.43] | 
|
| Cp,gas | 234.49 | J/mol×K | 468.32 | Joback Calculated Property |
| Cp,gas | 245.52 | J/mol×K | 503.50 | Joback Calculated Property |
| Cp,gas | 255.89 | J/mol×K | 538.69 | Joback Calculated Property |
| Cp,gas | 265.67 | J/mol×K | 573.87 | Joback Calculated Property |
| Cp,gas | 274.86 | J/mol×K | 609.06 | Joback Calculated Property |
| Cp,gas | 283.51 | J/mol×K | 644.24 | Joback Calculated Property |
| Cp,gas | 291.66 | J/mol×K | 679.43 | Joback Calculated Property |
| η | [0.0003368; 0.0061816] | Pa×s | [246.98; 468.32] |
|
| η | 0.0061816 | Pa×s | 246.98 | Joback Calculated Property |
| η | 0.0027773 | Pa×s | 283.87 | Joback Calculated Property |
| η | 0.0014999 | Pa×s | 320.76 | Joback Calculated Property |
| η | 0.0009198 | Pa×s | 357.65 | Joback Calculated Property |
| η | 0.0006181 | Pa×s | 394.54 | Joback Calculated Property |
| η | 0.0004446 | Pa×s | 431.43 | Joback Calculated Property |
| η | 0.0003368 | Pa×s | 468.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexane, 2,3-dibromo-, threo.
Sources
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