- InChI
- InChI=1S/C8H10O2/c1-4-6-10-8(9)7(3)5-2/h1,5H,6H2,2-3H3/b7-5+
- InChI Key
- IOODRSZMVRTKBM-FNORWQNLSA-N
- Formula
- C8H10O2
- SMILES
- C#CCOC(=O)C(C)=CC
- Molecular Weight1
- 138.16
- 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° | 77.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -53.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.45 | kJ/mol | Joback Calculated Property |
| log10WS | -1.68 | Crippen Calculated Property | |
| logPoct/wat | 1.129 | Crippen Calculated Property | |
| McVol | 118.120 | ml/mol | McGowan Calculated Property |
| Pc | 3322.01 | kPa | Joback Calculated Property |
| Inp | 1042.00 | NIST | |
| Tboil | 452.89 | K | Joback Calculated Property |
| Tc | 653.15 | K | Joback Calculated Property |
| Tfus | 280.01 | K | Joback Calculated Property |
| Vc | 0.451 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [233.05; 288.66] | J/mol×K | [452.89; 653.15] | 
|
| Cp,gas | 233.05 | J/mol×K | 452.89 | Joback Calculated Property |
| Cp,gas | 243.56 | J/mol×K | 486.27 | Joback Calculated Property |
| Cp,gas | 253.56 | J/mol×K | 519.64 | Joback Calculated Property |
| Cp,gas | 263.04 | J/mol×K | 553.02 | Joback Calculated Property |
| Cp,gas | 272.04 | J/mol×K | 586.40 | Joback Calculated Property |
| Cp,gas | 280.58 | J/mol×K | 619.77 | Joback Calculated Property |
| Cp,gas | 288.66 | J/mol×K | 653.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Prop-2-ynyl (E)-2-methylbut-2-enoate.
Sources
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