- InChI
- InChI=1S/C6H9ClO2/c1-3-4-9-6(8)5(2)7/h3,5H,1,4H2,2H3
- InChI Key
- FDCTVCOKDZZPRP-UHFFFAOYSA-N
- Formula
- C6H9ClO2
- SMILES
- C=CCOC(=O)C(C)Cl
- Molecular Weight1
- 148.59
- CAS
- 55360-11-7
- Other Names
-
- allyl 2-chloropropionate
- 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.
- I : 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 |
|---|---|---|---|
| ΔfG° | -160.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -307.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.43 | kJ/mol | Joback Calculated Property |
| log10WS | -1.32 | Crippen Calculated Property | |
| logPoct/wat | 1.343 | Crippen Calculated Property | |
| McVol | 110.780 | ml/mol | McGowan Calculated Property |
| Pc | 3322.01 | kPa | Joback Calculated Property |
| Inp | [904.00; 949.00] |
|
|
| Inp | 914.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 928.00 | NIST | |
| Inp | 949.00 | NIST | |
| Inp | 935.00 | NIST | |
| I | [1382.00; 1387.00] |
|
|
| I | 1385.00 | NIST | |
| I | 1382.00 | NIST | |
| I | 1387.00 | NIST | |
| I | 1385.00 | NIST | |
| Tboil | 446.64 | K | Joback Calculated Property |
| Tc | 639.20 | K | Joback Calculated Property |
| Tfus | 242.70 | K | Joback Calculated Property |
| Vc | 0.419 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [209.02; 258.51] | J/mol×K | [446.64; 639.20] |
|
| Cp,gas | 209.02 | J/mol×K | 446.64 | Joback Calculated Property |
| Cp,gas | 218.22 | J/mol×K | 478.73 | Joback Calculated Property |
| Cp,gas | 227.03 | J/mol×K | 510.83 | Joback Calculated Property |
| Cp,gas | 235.46 | J/mol×K | 542.92 | Joback Calculated Property |
| Cp,gas | 243.52 | J/mol×K | 575.02 | Joback Calculated Property |
| Cp,gas | 251.20 | J/mol×K | 607.11 | Joback Calculated Property |
| Cp,gas | 258.51 | J/mol×K | 639.20 | Joback Calculated Property |
| η | [0.0002870; 0.0039061] | Pa×s | [242.70; 446.64] |
|
| η | 0.0039061 | Pa×s | 242.70 | Joback Calculated Property |
| η | 0.0019351 | Pa×s | 276.69 | Joback Calculated Property |
| η | 0.0011179 | Pa×s | 310.68 | Joback Calculated Property |
| η | 0.0007196 | Pa×s | 344.67 | Joback Calculated Property |
| η | 0.0005014 | Pa×s | 378.66 | Joback Calculated Property |
| η | 0.0003707 | Pa×s | 412.65 | Joback Calculated Property |
| η | 0.0002870 | Pa×s | 446.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 2-chloro-, 2-propenyl ester.
Sources
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