- InChI
- InChI=1S/C6Br4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11
- InChI Key
- LWHDQPLUIFIFFT-UHFFFAOYSA-N
- Formula
- C6Br4O2
- SMILES
- O=C1C(Br)=C(Br)C(=O)C(Br)=C1Br
- Molecular Weight1
- 423.68
- CAS
- 488-48-2
- Other Names
-
- p-Bromanil
- Tetrabromo-p-benzoquinone
- Bromanil
- 2,5-Cyclohexadiene-1,4-dione, 2,3,5,6-tetrabromo-
- p-Benzoquinone, 2,3,5,6-tetrabromo-
- Tetrabromoquinone
- 2,3,5,6-Tetrabromo-p-benzoquinone
- 2,3,5,6-Tetrabromo-1,4-benzoquinone
- p-Bromoanil
- NSC 36927
- p-Benzoquinone, tetrabromo-
- p-Quinone, tetrabromo-
- Tetrabromobenzoquinone
- Tetrabromo-p-quinone
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | -134.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -192.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.15 | kJ/mol | Joback Calculated Property |
| IE | 9.59 | eV | NIST |
| log10WS | -4.20 | Crippen Calculated Property | |
| logPoct/wat | 3.141 | Crippen Calculated Property | |
| McVol | 149.080 | ml/mol | McGowan Calculated Property |
| Pc | 6967.65 | kPa | Joback Calculated Property |
| Tboil | 779.42 | K | Joback Calculated Property |
| Tc | 1086.46 | K | Joback Calculated Property |
| Tfus | 596.24 | K | Joback Calculated Property |
| Vc | 0.539 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [246.69; 270.27] | J/mol×K | [779.42; 1086.46] | 
|
| Cp,gas | 246.69 | J/mol×K | 779.42 | Joback Calculated Property |
| Cp,gas | 252.80 | J/mol×K | 830.59 | Joback Calculated Property |
| Cp,gas | 258.12 | J/mol×K | 881.77 | Joback Calculated Property |
| Cp,gas | 262.60 | J/mol×K | 932.94 | Joback Calculated Property |
| Cp,gas | 266.16 | J/mol×K | 984.12 | Joback Calculated Property |
| Cp,gas | 268.74 | J/mol×K | 1035.29 | Joback Calculated Property |
| Cp,gas | 270.27 | J/mol×K | 1086.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tetrabromo-1,4-benzoquinone.
Sources
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