- InChI
- InChI=1S/C9H5Cl2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
- InChI Key
- WDFKMLRRRCGAKS-UHFFFAOYSA-N
- Formula
- C9H5Cl2NO
- SMILES
- Oc1c(Cl)cc(Cl)c2cccnc12
- Molecular Weight1
- 214.05
- CAS
- 773-76-2
- Other Names
-
- 5,7-Dichlor-8-hydroxychinolin
- 5,7-Dichloro-8-Hydroxyquinoline
- 5,7-Dichloro-8-hydroquinoline
- 5,7-Dichloro-8-oxyquinoline
- 5,7-Dichloro-8-quinolinol
- 5,7-Dichlorooxine
- 5,7-Dichloroxine
- 5,7-dichloroquinolin-8-ol
- 8-Quinolinol, 5,7-dichloro-
- CHQ
- Capitrol
- Chlofucid
- Chloroxyquinoline
- Chlorquinol
- Clofuzid
- Dichlorohydroxyquinoline
- Dichloroquinolinol
- Dichloroxin
- Dikhloroskin
- Endiaron
- NSC 3904
- Quesyl
- Quinolor
- Quixalin
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- 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.
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry.
Do not hesitate to contact us for your projects.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5832 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -4145.30 ± 1.30 | kJ/mol | NIST |
| ΔfG° | 43.83 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -48.80 ± 1.90 | kJ/mol | NIST |
| ΔfH°solid | -158.10 ± 1.80 | kJ/mol | NIST |
| ΔsubH° | [92.90; 109.30] | kJ/mol |
|
| ΔsubH° | 109.30 ± 0.70 | kJ/mol | NIST |
| ΔsubH° | 92.90 ± 0.80 | kJ/mol | NIST |
| ΔvapH° | 85.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.247 | Crippen Calculated Property | |
| McVol | 134.780 | ml/mol | McGowan Calculated Property |
| Pc | 5301.03 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 573.60 | K | Relay (1.0) Calculated Property |
| Tc | 912.54 | K | Relay (1.0) Calculated Property |
| Tfus | 368.67 | K | Relay (1.0) Calculated Property |
| Ttriple | 452.15 | K | Solid-Liquid Equilibrium of 5-Chloro-8-hydroxyquinoline and 5,7-Dichloro-8-hydroxyquinoline in Different Solvents and Mixing Properties of Solutions |
| Vc | 0.484 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔsubH | [92.90; 106.30] | kJ/mol | [358.50; 378.00] |
|
| ΔsubH | 106.30 ± 0.70 | kJ/mol | 358.50 | NIST |
| ΔsubH | 92.90 | kJ/mol | 378.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [472.76; 600.13] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 2.39584e+01 | |||
| Coefficient B | -1.11906e+04 | |||
| Temperature range, min. | 472.76 | |||
| Temperature range, max. | 600.13 | |||
| Pvap | 1.33 | kPa | 472.76 | Calculated Property |
| Pvap | 2.65 | kPa | 486.91 | Calculated Property |
| Pvap | 5.08 | kPa | 501.06 | Calculated Property |
| Pvap | 9.38 | kPa | 515.22 | Calculated Property |
| Pvap | 16.76 | kPa | 529.37 | Calculated Property |
| Pvap | 29.06 | kPa | 543.52 | Calculated Property |
| Pvap | 49.00 | kPa | 557.67 | Calculated Property |
| Pvap | 80.52 | kPa | 571.83 | Calculated Property |
| Pvap | 129.17 | kPa | 585.98 | Calculated Property |
| Pvap | 202.66 | kPa | 600.13 | Calculated Property |
Similar Compounds
Find more compounds similar to Chloroxine.
Mixtures
- Chloroxine + Ethyl Acetate
- Toluene + Chloroxine
- Chloroxine + Formamide, N,N-dimethyl-
- Chloroxine + 2-Pyrrolidinone, 1-methyl-
- Acetonitrile + Chloroxine
- Chloroxine + 1,4-Dioxane
- Chloroxine + Formamide, N,N-dimethyl- + Water
- Chloroxine + Dimethyl Sulfoxide + Water
- Chloroxine + 2-Pyrrolidinone, 1-methyl- + Water
- Chloroxine + 1,4-Dioxane + Water
- Chloroxine + Water
- Chloroxine + Dimethyl Sulfoxide
- Chloroxine + Ethyl Acetate + Methyl Alcohol
- Chloroxine + Ethanol + Ethyl Acetate
- 1-Propanol + Chloroxine + Ethyl Acetate
- Isopropyl Alcohol + Chloroxine + Ethyl Acetate
- Chloroxine + Methyl Alcohol
- Chloroxine + Ethanol
- 1-Propanol + Chloroxine
- Isopropyl Alcohol + Chloroxine
Find more mixtures with Chloroxine.
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
- Solubility of chloroxine in aqueous co-solvent mixtures of N,N-dimethylformamide, dimethyl sulfoxide, N-methyl-2-pyrrolidone and 1,4-dioxane: Determination, solvent effect and preferential solvation analysis
- Cosolvency and Mathematical Modeling Analysis of Chloroxine in Some Binary Solvent System
- Solid-Liquid Equilibrium of 5-Chloro-8-hydroxyquinoline and 5,7-Dichloro-8-hydroxyquinoline in Different Solvents and Mixing Properties of Solutions
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.