- InChI
- InChI=1S/C12H4Cl4O/c13-5-2-1-3-8-9(5)10-6(14)4-7(15)11(16)12(10)17-8/h1-4H
- InChI Key
- PNCYJHOTZSKZPA-UHFFFAOYSA-N
- Formula
- C12H4Cl4O
- SMILES
-
Clc1cc(Cl)c2c(oc3cccc(Cl)c32)c
1Cl - Molecular Weight1
- 305.97
- Other Names
-
- 1,3,4,9-tetrachlorodibenzofuran
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.5704 | Relay (1.0) Calculated Property | |
| ΔfG° | 28.31 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 11.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 96.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.30 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.200 | Crippen Calculated Property | |
| McVol | 176.390 | ml/mol | McGowan Calculated Property |
| Pc | 2644.07 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2325.00; 2333.00] |
|
|
| Inp | 2325.00 | NIST | |
| Inp | 2333.00 | NIST | |
| Inp | 2325.00 | NIST | |
| Inp | 2333.00 | NIST | |
| Inp | 2325.00 | NIST | |
| Tboil | 642.51 | K | Relay (1.0) Calculated Property |
| Tc | 960.54 | K | Relay (1.0) Calculated Property |
| Tfus | 406.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.661 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dibenzofuran, 1,3,4,9-tetrachloro.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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