- InChI
- InChI=1S/C12H2Cl6O/c13-4-1-3-7-8(16)5(14)2-6(15)12(7)19-11(3)10(18)9(4)17/h1-2H
- InChI Key
- CKDDYGBBKXIHRY-UHFFFAOYSA-N
- Formula
- C12H2Cl6O
- SMILES
-
Clc1cc2c(oc3c(Cl)cc(Cl)c(Cl)c3
2)c(Cl)c1Cl - Molecular Weight1
- 374.86
- 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 | 0.6446 | Relay (1.0) Calculated Property | |
| ΔfG° | -36.59 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -32.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 111.47 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.40 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.97 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.506 | Crippen Calculated Property | |
| McVol | 200.870 | ml/mol | McGowan Calculated Property |
| Pc | 2380.60 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2665.00 | NIST | |
| Tboil | 664.52 | K | Relay (1.0) Calculated Property |
| Tc | 1006.81 | K | Relay (1.0) Calculated Property |
| Tfus | 455.93 | K | Relay (1.0) Calculated Property |
| Vc | 0.752 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dibenzofuran, 1,2,4,6,7,8-hexachloro.
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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