- InChI
- InChI=1S/C7H10O2/c1-3-5-7(8)9-6-4-2/h3-5H,2,6H2,1H3/b5-3+
- InChI Key
- WNJBUWVXSNLWEQ-HWKANZROSA-N
- Formula
- C7H10O2
- SMILES
- C=CCOC(=O)C=CC
- Molecular Weight1
- 126.15
- CAS
- 20474-93-5
- Other Names
-
- Crotonic acid, allyl ester
- Allyl crotonate
- Allyl (2e)-2-butenoate
- allyl 2-butenoate
- 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).
- 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° | -57.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -189.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.62 | kJ/mol | Joback Calculated Property |
| log10WS | -1.32 | Crippen Calculated Property | |
| logPoct/wat | 1.292 | Crippen Calculated Property | |
| McVol | 108.330 | ml/mol | McGowan Calculated Property |
| Pc | 3265.31 | kPa | Joback Calculated Property |
| Tboil | 436.69 | K | Joback Calculated Property |
| Tc | 625.64 | K | Joback Calculated Property |
| Tfus | 233.97 | K | Joback Calculated Property |
| Vc | 0.412 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [206.84; 260.75] | J/mol×K | [436.69; 625.64] | 
|
| Cp,gas | 206.84 | J/mol×K | 436.69 | Joback Calculated Property |
| Cp,gas | 216.93 | J/mol×K | 468.18 | Joback Calculated Property |
| Cp,gas | 226.56 | J/mol×K | 499.67 | Joback Calculated Property |
| Cp,gas | 235.74 | J/mol×K | 531.17 | Joback Calculated Property |
| Cp,gas | 244.49 | J/mol×K | 562.66 | Joback Calculated Property |
| Cp,gas | 252.82 | J/mol×K | 594.15 | Joback Calculated Property |
| Cp,gas | 260.75 | J/mol×K | 625.64 | Joback Calculated Property |
| η | [0.0002196; 0.0026175] | Pa×s | [233.97; 436.69] |
|
| η | 0.0026175 | Pa×s | 233.97 | Joback Calculated Property |
| η | 0.0013346 | Pa×s | 267.76 | Joback Calculated Property |
| η | 0.0007914 | Pa×s | 301.54 | Joback Calculated Property |
| η | 0.0005214 | Pa×s | 335.33 | Joback Calculated Property |
| η | 0.0003708 | Pa×s | 369.12 | Joback Calculated Property |
| η | 0.0002792 | Pa×s | 402.90 | Joback Calculated Property |
| η | 0.0002196 | Pa×s | 436.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butenoic acid, 2-propenyl ester.
Sources
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