- InChI
- InChI=1S/C3H5ClO2/c4-2-1-3(5)6/h1-2H2,(H,5,6)
- InChI Key
- QEYMMOKECZBKAC-UHFFFAOYSA-N
- Formula
- C3H5ClO2
- SMILES
- O=C(O)CCCl
- Molecular Weight1
- 108.52
- CAS
- 107-94-8
- Other Names
-
- Propionic acid, 3-chloro-
- «beta»-Chloropropionic acid
- «beta»-Monochloropropionic acid
- 3-Chloropropanoic acid
- 3-Chloropropionic acid
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | [-1370.00; -1366.00] | kJ/mol |
|
| ΔcH°solid | -1370.00 ± 3.00 | kJ/mol | NIST |
| ΔcH°solid | -1366.00 | kJ/mol | NIST |
| ΔfG° | -303.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -385.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.08 | kJ/mol | Joback Calculated Property |
| log10WS | -0.33 | Crippen Calculated Property | |
| logPoct/wat | 0.700 | Crippen Calculated Property | |
| McVol | 72.810 | ml/mol | McGowan Calculated Property |
| Pc | 5190.64 | kPa | Joback Calculated Property |
| Inp | [960.40; 970.00] |
|
|
| Inp | 970.00 | NIST | |
| Inp | 960.40 | NIST | |
| Tboil | 477.20 | K | NIST |
| Tc | 633.22 | K | Joback Calculated Property |
| Tfus | 314.00 ± 4.00 | K | NIST |
| Vc | 0.278 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [130.07; 156.61] | J/mol×K | [451.52; 633.22] |
|
| Cp,gas | 130.07 | J/mol×K | 451.52 | Joback Calculated Property |
| Cp,gas | 135.03 | J/mol×K | 481.80 | Joback Calculated Property |
| Cp,gas | 139.77 | J/mol×K | 512.09 | Joback Calculated Property |
| Cp,gas | 144.30 | J/mol×K | 542.37 | Joback Calculated Property |
| Cp,gas | 148.61 | J/mol×K | 572.65 | Joback Calculated Property |
| Cp,gas | 152.71 | J/mol×K | 602.93 | Joback Calculated Property |
| Cp,gas | 156.61 | J/mol×K | 633.22 | Joback Calculated Property |
| η | [0.0003073; 0.0223163] | Pa×s | [264.24; 451.52] |
|
| η | 0.0223163 | Pa×s | 264.24 | Joback Calculated Property |
| η | 0.0074920 | Pa×s | 295.45 | Joback Calculated Property |
| η | 0.0030985 | Pa×s | 326.67 | Joback Calculated Property |
| η | 0.0014949 | Pa×s | 357.88 | Joback Calculated Property |
| η | 0.0008107 | Pa×s | 389.09 | Joback Calculated Property |
| η | 0.0004814 | Pa×s | 420.31 | Joback Calculated Property |
| η | 0.0003073 | Pa×s | 451.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 3-chloro-.
Sources
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