- InChI
- InChI=1S/C9H9Cl2NO2/c1-12-9(13)14-5-6-3-2-4-7(10)8(6)11/h2-4H,5H2,1H3,(H,12,13)
- InChI Key
- SESJCOBCXSACPH-UHFFFAOYSA-N
- Formula
- C9H9Cl2NO2
- SMILES
- CNC(=O)OCc1cccc(Cl)c1Cl
- Molecular Weight1
- 234.08
- CAS
- 2328-31-6
- Other Names
-
- 2,3-Dichlorobenzyl, N-methylcarbamate
- Benzenemethanol, 2,3-dichloro-, methylcarbamate
- 2,3-Dichlorobenzyl methylcarbamate
- 2,3-Sirmate
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -50.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.59 | kJ/mol | Joback Calculated Property |
| log10WS | -3.59 | Crippen Calculated Property | |
| logPoct/wat | 2.849 | Crippen Calculated Property | |
| McVol | 155.810 | ml/mol | McGowan Calculated Property |
| Pc | 3100.18 | kPa | Joback Calculated Property |
| Tboil | 643.28 | K | Joback Calculated Property |
| Tc | 869.01 | K | Joback Calculated Property |
| Tfus | 427.31 | K | Joback Calculated Property |
| Vc | 0.589 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [347.24; 400.12] | J/mol×K | [643.28; 869.01] | 
|
| Cp,gas | 347.24 | J/mol×K | 643.28 | Joback Calculated Property |
| Cp,gas | 357.77 | J/mol×K | 680.90 | Joback Calculated Property |
| Cp,gas | 367.60 | J/mol×K | 718.52 | Joback Calculated Property |
| Cp,gas | 376.74 | J/mol×K | 756.15 | Joback Calculated Property |
| Cp,gas | 385.20 | J/mol×K | 793.77 | Joback Calculated Property |
| Cp,gas | 392.99 | J/mol×K | 831.39 | Joback Calculated Property |
| Cp,gas | 400.12 | J/mol×K | 869.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbamic acid, N-methyl-, 2,3-dichlorobenzyl ester.
Sources
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