- InChI
- InChI=1S/C4H5ClO2/c1-3(2)7-4(5)6/h1H2,2H3
- InChI Key
- AMMGCGVWJMRTQI-UHFFFAOYSA-N
- Formula
- C4H5ClO2
- SMILES
- C=C(C)OC(=O)Cl
- Molecular Weight1
- 120.53
- CAS
- 57933-83-2
- Other Names
-
- Carbonochloridic acid, 1-methylethenyl ester
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -183.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -270.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.45 | kJ/mol | Joback Calculated Property |
| log10WS | -1.84 | Crippen Calculated Property | |
| logPoct/wat | 1.895 | Crippen Calculated Property | |
| McVol | 82.600 | ml/mol | McGowan Calculated Property |
| Pc | 4183.90 | kPa | Joback Calculated Property |
| Inp | 694.00 | NIST | |
| Tboil | 401.20 | K | Joback Calculated Property |
| Tc | 596.73 | K | Joback Calculated Property |
| Tfus | 221.20 | K | Joback Calculated Property |
| Vc | 0.315 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [136.77; 170.10] | J/mol×K | [401.20; 596.73] | 
|
| Cp,gas | 136.77 | J/mol×K | 401.20 | Joback Calculated Property |
| Cp,gas | 142.91 | J/mol×K | 433.79 | Joback Calculated Property |
| Cp,gas | 148.80 | J/mol×K | 466.38 | Joback Calculated Property |
| Cp,gas | 154.47 | J/mol×K | 498.97 | Joback Calculated Property |
| Cp,gas | 159.91 | J/mol×K | 531.55 | Joback Calculated Property |
| Cp,gas | 165.12 | J/mol×K | 564.14 | Joback Calculated Property |
| Cp,gas | 170.10 | J/mol×K | 596.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isopropenyl chloroformate.
Sources
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