- InChI
- InChI=1S/C6HBr5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
- InChI Key
- SVHOVVJFOWGYJO-UHFFFAOYSA-N
- Formula
- C6HBr5O
- SMILES
- Oc1c(Br)c(Br)c(Br)c(Br)c1Br
- Molecular Weight1
- 488.59
- CAS
- 608-71-9
- Other Names
-
- 2,3,4,5,6-pentabromophenol
- Flammex 5BP
- Pentabromfenol
- pentabromophenol
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (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° | -9.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -22.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.06 | kJ/mol | Joback Calculated Property |
| log10WS | -6.83 | Crippen Calculated Property | |
| logPoct/wat | 5.205 | Crippen Calculated Property | |
| McVol | 165.010 | ml/mol | McGowan Calculated Property |
| Pc | 9444.29 | kPa | Joback Calculated Property |
| Tboil | 794.70 | K | Joback Calculated Property |
| Tc | 1099.10 | K | Joback Calculated Property |
| Tfus | 644.60 | K | Joback Calculated Property |
| Ttriple | 416.20 | K | Measure... |
| Vc | 0.539 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [248.14; 279.37] | J/mol×K | [794.70; 1099.10] | 
|
|
T(K) Ideal gas heat capacity (J/mol×K) 250 255 260 265 270 275 280 800 900 1000 1100 | ||||
| Cp,gas | 248.14 | J/mol×K | 794.70 | Joback Calculated Property |
| Cp,gas | 251.87 | J/mol×K | 845.43 | Joback Calculated Property |
| Cp,gas | 255.89 | J/mol×K | 896.17 | Joback Calculated Property |
| Cp,gas | 260.42 | J/mol×K | 946.90 | Joback Calculated Property |
| Cp,gas | 265.69 | J/mol×K | 997.63 | Joback Calculated Property |
| Cp,gas | 271.93 | J/mol×K | 1048.36 | Joback Calculated Property |
| Cp,gas | 279.37 | J/mol×K | 1099.10 | Joback Calculated Property |
| η | [0.0000136; 0.0000531] | Pa×s | [644.60; 794.70] |
|
|
T(K) Dynamic viscosity (Pa×s) 1.00e-5 2.00e-5 3.00e-5 4.00e-5 5.00e-5 650 700 750 | ||||
| η | 0.0000531 | Pa×s | 644.60 | Joback Calculated Property |
| η | 0.0000406 | Pa×s | 669.62 | Joback Calculated Property |
| η | 0.0000316 | Pa×s | 694.63 | Joback Calculated Property |
| η | 0.0000251 | Pa×s | 719.65 | Joback Calculated Property |
| η | 0.0000202 | Pa×s | 744.67 | Joback Calculated Property |
| η | 0.0000165 | Pa×s | 769.68 | Joback Calculated Property |
| η | 0.0000136 | Pa×s | 794.70 | Joback Calculated Property |
| ΔfusH | [11.29; 27.60] | kJ/mol | [441.50; 502.00] |
|
| ΔfusH | 11.29 | kJ/mol | 441.50 | NIST |
| ΔfusH | 27.60 | kJ/mol | 469.80 | NIST |
| ΔfusH | 19.14 | kJ/mol | 502.00 | NIST |
| ΔfusH | 19.14 | kJ/mol | 502.00 | NIST |
| ΔfusS | [25.57; 38.13] | J/mol×K | [441.50; 502.00] |
|
| ΔfusS | 25.57 | J/mol×K | 441.50 | NIST |
| ΔfusS | 38.13 | J/mol×K | 502.00 | NIST |
Similar Compounds
Find more compounds similar to Phenol, pentabromo-.
Sources
- Crippen Method
- Crippen Method
- Measurement of Vapor Pressures and Melting Properties of Five Polybrominated Aromatic Flame Retardants
- Joback Method
- McGowan Method
- NIST Webbook
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