- InChI
- InChI=1S/C3H6ClNO/c1-5-3(6)2-4/h2H2,1H3,(H,5,6)
- InChI Key
- HOZLOOPIXHWKCI-UHFFFAOYSA-N
- Formula
- C3H6ClNO
- SMILES
- CNC(=O)CCl
- Molecular Weight1
- 107.54
- CAS
- 96-30-0
- Other Names
-
- Acetamide, 2-chloro-N-methyl-
- N-Methyl-2-chloroacetamide
- N-Methylchloroacetamide
- USAF DO-35
- «alpha»-Chloro-N-methylacetamide
- ClCON(CH3)2
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.4193 | Relay (1.0) Calculated Property | |
| PAff | 845.80 | kJ/mol | NIST |
| BasG | 814.80 | kJ/mol | NIST |
| ΔfG° | -77.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -278.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.77 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.64 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.029 | Crippen Calculated Property | |
| McVol | 76.920 | ml/mol | McGowan Calculated Property |
| Pc | 4646.65 | kPa | Joback Calculated Property |
| Tboil | 462.61 | K | Relay (1.0) Calculated Property |
| Tc | 684.37 | K | Relay (1.0) Calculated Property |
| Tfus | 293.04 | K | Relay (1.0) Calculated Property |
| Vc | 0.273 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [130.59; 165.26] | J/mol×K | [409.51; 603.29] | 
|
| Cp,gas | 130.59 | J/mol×K | 409.51 | Joback Calculated Property |
| Cp,gas | 137.09 | J/mol×K | 441.81 | Joback Calculated Property |
| Cp,gas | 143.29 | J/mol×K | 474.10 | Joback Calculated Property |
| Cp,gas | 149.20 | J/mol×K | 506.40 | Joback Calculated Property |
| Cp,gas | 154.83 | J/mol×K | 538.70 | Joback Calculated Property |
| Cp,gas | 160.18 | J/mol×K | 570.99 | Joback Calculated Property |
| Cp,gas | 165.26 | J/mol×K | 603.29 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 386.50 ± 1.50 | K | 2.70 | NIST |
Similar Compounds
Find more compounds similar to 2-Chloro-N-methylacetamide.
Sources
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