- InChI
- InChI=1S/C3H6ClNO/c1-2(4)3(5)6/h2H,1H3,(H2,5,6)
- InChI Key
- OEZPDHRXGCLGKB-UHFFFAOYSA-N
- Formula
- C3H6ClNO
- SMILES
- CC(Cl)C(N)=O
- Molecular Weight1
- 107.54
- CAS
- 27816-36-0
- Other Names
-
- Propanamide, 2-chloro-
- 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 | 0.4568 | Relay (1.0) Calculated Property | |
| ΔfG° | -102.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -341.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.47 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.17 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.099 | Crippen Calculated Property | |
| McVol | 76.920 | ml/mol | McGowan Calculated Property |
| Pc | 4994.44 | kPa | Joback Calculated Property |
| Tboil | 436.73 | K | Relay (1.0) Calculated Property |
| Tc | 642.97 | K | Relay (1.0) Calculated Property |
| Tfus | 303.85 | K | Relay (1.0) Calculated Property |
| Vc | 0.280 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [137.80; 172.32] | J/mol×K | [431.43; 641.04] | 
|
| Cp,gas | 137.80 | J/mol×K | 431.43 | Joback Calculated Property |
| Cp,gas | 144.37 | J/mol×K | 466.37 | Joback Calculated Property |
| Cp,gas | 150.60 | J/mol×K | 501.30 | Joback Calculated Property |
| Cp,gas | 156.50 | J/mol×K | 536.24 | Joback Calculated Property |
| Cp,gas | 162.08 | J/mol×K | 571.17 | Joback Calculated Property |
| Cp,gas | 167.35 | J/mol×K | 606.11 | Joback Calculated Property |
| Cp,gas | 172.32 | J/mol×K | 641.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloropropionamide.
Sources
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