- InChI
- InChI=1S/C10H11Cl2NO3/c1-15-6-3-4-8(16-2)7(5-6)13-10(14)9(11)12/h3-5,9H,1-2H3,(H,13,14)
- InChI Key
- MRFYBJFXENFYEJ-UHFFFAOYSA-N
- Formula
- C10H11Cl2NO3
- SMILES
- COc1ccc(OC)c(NC(=O)C(Cl)Cl)c1
- Molecular Weight1
- 264.11
- 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).
- 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 | 0.6656 | Relay (1.0) Calculated Property | |
| ΔfG° | -149.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -441.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.446 | Crippen Calculated Property | |
| McVol | 175.770 | ml/mol | McGowan Calculated Property |
| Pc | 2767.17 | kPa | Joback Calculated Property |
| Inp | 1889.00 | NIST | |
| Tboil | 598.30 | K | Relay (1.0) Calculated Property |
| Tc | 855.67 | K | Relay (1.0) Calculated Property |
| Tfus | 376.27 | K | Relay (1.0) Calculated Property |
| Vc | 0.617 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [419.73; 476.14] | J/mol×K | [688.14; 911.26] | 
|
| Cp,gas | 419.73 | J/mol×K | 688.14 | Joback Calculated Property |
| Cp,gas | 431.11 | J/mol×K | 725.33 | Joback Calculated Property |
| Cp,gas | 441.70 | J/mol×K | 762.51 | Joback Calculated Property |
| Cp,gas | 451.50 | J/mol×K | 799.70 | Joback Calculated Property |
| Cp,gas | 460.51 | J/mol×K | 836.89 | Joback Calculated Property |
| Cp,gas | 468.73 | J/mol×K | 874.07 | Joback Calculated Property |
| Cp,gas | 476.14 | J/mol×K | 911.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-(2,5-dimethoxyphenyl)-2,2-dichloro-.
Sources
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