- InChI
- InChI=1S/C10H9Br5O/c1-2-3-16-4-5-6(11)8(13)10(15)9(14)7(5)12/h2-4H2,1H3
- InChI Key
- BUKHQPTWTSHKBX-UHFFFAOYSA-N
- Formula
- C10H9Br5O
- SMILES
-
CCCOCc1c(Br)c(Br)c(Br)c(Br)c1B
r - Molecular Weight1
- 544.70
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 64.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -71.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.02 | kJ/mol | Joback Calculated Property |
| log10WS | -8.51 | Crippen Calculated Property | |
| logPoct/wat | 6.426 | Crippen Calculated Property | |
| McVol | 221.370 | ml/mol | McGowan Calculated Property |
| Pc | 3935.71 | kPa | Joback Calculated Property |
| Inp | 2621.00 | NIST | |
| Tboil | 833.00 | K | Joback Calculated Property |
| Tc | 1099.01 | K | Joback Calculated Property |
| Tfus | 612.71 | K | Joback Calculated Property |
| Vc | 0.816 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [436.54; 479.89] | J/mol×K | [833.00; 1099.01] | 
|
| Cp,gas | 436.54 | J/mol×K | 833.00 | Joback Calculated Property |
| Cp,gas | 444.87 | J/mol×K | 877.34 | Joback Calculated Property |
| Cp,gas | 452.67 | J/mol×K | 921.67 | Joback Calculated Property |
| Cp,gas | 460.01 | J/mol×K | 966.01 | Joback Calculated Property |
| Cp,gas | 466.95 | J/mol×K | 1010.34 | Joback Calculated Property |
| Cp,gas | 473.56 | J/mol×K | 1054.68 | Joback Calculated Property |
| Cp,gas | 479.89 | J/mol×K | 1099.01 | Joback Calculated Property |
| η | [0.0000980; 0.0002979] | Pa×s | [612.71; 833.00] |
|
| η | 0.0002979 | Pa×s | 612.71 | Joback Calculated Property |
| η | 0.0002349 | Pa×s | 649.43 | Joback Calculated Property |
| η | 0.0001900 | Pa×s | 686.14 | Joback Calculated Property |
| η | 0.0001570 | Pa×s | 722.86 | Joback Calculated Property |
| η | 0.0001322 | Pa×s | 759.57 | Joback Calculated Property |
| η | 0.0001130 | Pa×s | 796.29 | Joback Calculated Property |
| η | 0.0000980 | Pa×s | 833.00 | Joback Calculated Property |
Similar Compounds
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Sources
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