![Urea, N'-[4-(4-methoxyphenoxy)phenyl]-N,N-dimethyl-](/cid/119-295-3/Urea-N-4-4-methoxyphenoxy-phenyl-N-N-dimethyl.png "Urea, N'-[4-(4-methoxyphenoxy)phenyl]-N,N-dimethyl-")
- InChI
- InChI=1S/C16H18N2O3/c1-18(2)16(19)17-12-4-6-14(7-5-12)21-15-10-8-13(20-3)9-11-15/h4-11H,1-3H3,(H,17,19)
- InChI Key
- AMVYOVYGIJXTQB-UHFFFAOYSA-N
- Formula
- C16H18N2O3
- SMILES
-
COc1ccc(Oc2ccc(NC(=O)N(C)C)cc2
)cc1 - Molecular Weight1
- 286.33
- CAS
- 14214-32-5
- Other Names
-
- C 3470
- Difenoxuron
- Difenoxurone
- Lironion
- N'-(4-(4-Methoxyphenoxy)phenyl)-N,N-dimethylurea
- Pinoran
- Urea, 1,1-dimethyl-3-(p-(p-methoxyphenoxy)phenyl)-
- ω : Acentric Factor.
- 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 |
|---|---|---|---|
| ω | 0.8069 | Relay (1.0) Calculated Property | |
| ΔfG° | 150.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -279.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.18 | eV | Relay (1.0) Calculated Property |
| log10WS | [-4.16; -4.16] |
|
|
| log10WS | -4.16 | Aq. Solubility Prediction | |
| log10WS | -4.16 | Estimated Solubility | |
| logPoct/wat | 3.581 | Crippen Calculated Property | |
| McVol | 222.050 | ml/mol | McGowan Calculated Property |
| Pc | 2306.95 | kPa | Joback Calculated Property |
| Tboil | 664.44 | K | Relay (1.0) Calculated Property |
| Tc | 949.79 | K | Relay (1.0) Calculated Property |
| Tfus | 430.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.808 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [636.97; 706.37] | J/mol×K | [790.12; 1016.83] |
|
| Cp,gas | 636.97 | J/mol×K | 790.12 | Joback Calculated Property |
| Cp,gas | 651.44 | J/mol×K | 827.90 | Joback Calculated Property |
| Cp,gas | 664.70 | J/mol×K | 865.69 | Joback Calculated Property |
| Cp,gas | 676.79 | J/mol×K | 903.47 | Joback Calculated Property |
| Cp,gas | 687.74 | J/mol×K | 941.26 | Joback Calculated Property |
| Cp,gas | 697.59 | J/mol×K | 979.04 | Joback Calculated Property |
| Cp,gas | 706.37 | J/mol×K | 1016.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Urea, N'-[4-(4-methoxyphenoxy)phenyl]-N,N-dimethyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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