- InChI
- InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)
- InChI Key
- XMTQQYYKAHVGBJ-UHFFFAOYSA-N
- Formula
- C9H10Cl2N2O
- SMILES
- CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
- Molecular Weight1
- 233.09
- CAS
- 330-54-1
- Other Names
-
- 1,1-Dimethyl-3-(3,4-dichlorophenyl)urea
- 1-(3,4-Dichlorophenyl)-3,3-dimethylurea
- 3-(3,4-Dichloor-fenyl)-1,1-dimethylureum
- 3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff
- 3-(3,4-Dichlorophenol)-1,1-dimethylurea
- 3-(3,4-Dichlorophenyl)-1,1-dimethylurea
- 3-(3,4-Dicloro-fenyl)-1,1-dimetil-urea
- Aguron
- Cekiuron
- Crisuron
- DCMU
- DCMU 99
- DMU
- DP Hardener 95
- Dailon
- Di-On
- Diater
- Dichlorfenidim
- Direx 4L
- Direx 80W
- Diuron 4L
- Diuron Nortox
- Duran
- Dynex
- HW 920
- Herbatox
- Karamex
- Karmex
- Karmex 80W
- Karmex D
- Karmex DL
- Karmex DW
- Karmex Diuron Herbicide
- Lucenit
- Marmer
- N'-(3,4-Dichlorophenyl)-N,N-dimethylurea
- N,N,-Dimethyl-N'-(3,4-dichlorophenyl)urea
- N-(3,4-Dichlorophenyl)-N',N'-dimethylurea
- Preventol A 6
- Telvar Diuron Weed Killer
- Unidron
- Urea, 3-(3,4-dichlorophenyl)-1,1-dimethyl-
- Urea, N'-(3,4-dichlorophenyl)-N,N-dimethyl-
- Urox D
- Vonduron
- Xarmex
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfH°solid : Solid phase 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).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -4681.90 ± 4.20 | kJ/mol | NIST |
| ΔfH°solid | -329.00 ± 4.20 | kJ/mol | NIST |
| ΔfusH° | 30.44 | kJ/mol | Joback Calculated Property |
| ΔsubH° | 133.90 ± 0.70 | kJ/mol | NIST |
| log10WS | [-3.80; -1.22] |
|
|
| log10WS | -1.22 | Aq. Solubility Prediction | |
| log10WS | -3.80 | Estimated Solubility | |
| log10WS | -3.76 | Rytting (2005) | |
| logPoct/wat | 3.087 | Crippen Calculated Property | |
| McVol | 159.920 | ml/mol | McGowan Calculated Property |
| Tfus | [429.70; 431.55] | K |
|
| Tfus | 431.55 | K | Aq. Solubility Prediction |
| Tfus | 430.70 ± 0.20 | K | NIST |
| Tfus | 429.70 ± 0.20 | K | NIST |
Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [360.44; 416.25] | J/mol×K | [633.50; 858.84] |
|
| Cp,gas | 360.44 | J/mol×K | 633.50 | Joback Calculated Property |
| Cp,gas | 371.63 | J/mol×K | 671.06 | Joback Calculated Property |
| Cp,gas | 382.01 | J/mol×K | 708.61 | Joback Calculated Property |
| Cp,gas | 391.63 | J/mol×K | 746.17 | Joback Calculated Property |
| Cp,gas | 400.51 | J/mol×K | 783.73 | Joback Calculated Property |
| Cp,gas | 408.70 | J/mol×K | 821.29 | Joback Calculated Property |
| Cp,gas | 416.25 | J/mol×K | 858.84 | Joback Calculated Property |
| ΔfusH | [25.28; 33.89] | kJ/mol | [429.70; 435.10] |
|
| ΔfusH | 33.89 | kJ/mol | 429.70 | NIST |
| ΔfusH | 30.47 | kJ/mol | 430.50 | NIST |
| ΔfusH | 25.28 | kJ/mol | 435.10 | NIST |
| ΔsubH | 119.00 ± 0.60 | kJ/mol | 393.00 | NIST |
Similar Compounds
Find more compounds similar to Diuron.
Sources
- 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
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- Aqueous and cosolvent solubility data for drug-like organic compounds
- McGowan Method
- NIST Webbook
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.
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