- InChI
- InChI=1S/C10H12ClNO2/c1-3-14-10(13)12-8-5-4-7(2)9(11)6-8/h4-6H,3H2,1-2H3,(H,12,13)
- InChI Key
- KJEXITNRKHKKBH-UHFFFAOYSA-N
- Formula
- C10H12ClNO2
- SMILES
- CCOC(=O)Nc1ccc(C)c(Cl)c1
- Molecular Weight1
- 213.66
- CAS
- 85419-40-5
- Other Names
-
- Ethyl 3-chloro-4-methylcarbanilate
- 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 | 0.6182 | Relay (1.0) Calculated Property | |
| ΔfG° | -29.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -399.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.02 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.217 | Crippen Calculated Property | |
| McVol | 157.660 | ml/mol | McGowan Calculated Property |
| Pc | 2906.11 | kPa | Joback Calculated Property |
| Tboil | 567.19 | K | Relay (1.0) Calculated Property |
| Tc | 801.34 | K | Relay (1.0) Calculated Property |
| Tfus | 358.27 | K | Relay (1.0) Calculated Property |
| Vc | 0.567 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [371.92; 434.34] | J/mol×K | [628.73; 847.09] | 
|
| Cp,gas | 371.92 | J/mol×K | 628.73 | Joback Calculated Property |
| Cp,gas | 384.13 | J/mol×K | 665.12 | Joback Calculated Property |
| Cp,gas | 395.60 | J/mol×K | 701.52 | Joback Calculated Property |
| Cp,gas | 406.35 | J/mol×K | 737.91 | Joback Calculated Property |
| Cp,gas | 416.38 | J/mol×K | 774.30 | Joback Calculated Property |
| Cp,gas | 425.71 | J/mol×K | 810.70 | Joback Calculated Property |
| Cp,gas | 434.34 | J/mol×K | 847.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl N-(3-chloro-4-methylphenyl)carbamate.
Sources
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