- InChI
- InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3-
- InChI Key
- XXHDAWYDNSXJQM-ARJAWSKDSA-N
- Formula
- C6H10O2
- SMILES
- CCC=CCC(=O)O
- Molecular Weight1
- 114.14
- CAS
- 1775-43-5
- Other Names
-
- (Z)-3-hexenoic acid
- (Z)-hex-2-enoic acid
- 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° | -185.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -314.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.33 | kJ/mol | Joback Calculated Property |
| log10WS | -1.29 | Crippen Calculated Property | |
| logPoct/wat | 1.427 | Crippen Calculated Property | |
| McVol | 98.540 | ml/mol | McGowan Calculated Property |
| Pc | 3970.51 | kPa | Joback Calculated Property |
| Inp | 1101.00 | NIST | |
| I | [1922.00; 1945.00] |
|
|
| I | 1945.00 | NIST | |
| I | 1922.00 | NIST | |
| Tboil | 486.89 | K | Joback Calculated Property |
| Tc | 665.94 | K | Joback Calculated Property |
| Tfus | 263.05 | K | Joback Calculated Property |
| Vc | 0.377 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [206.08; 250.80] | J/mol×K | [486.89; 665.94] |
|
| Cp,gas | 206.08 | J/mol×K | 486.89 | Joback Calculated Property |
| Cp,gas | 214.50 | J/mol×K | 516.73 | Joback Calculated Property |
| Cp,gas | 222.51 | J/mol×K | 546.57 | Joback Calculated Property |
| Cp,gas | 230.13 | J/mol×K | 576.41 | Joback Calculated Property |
| Cp,gas | 237.37 | J/mol×K | 606.26 | Joback Calculated Property |
| Cp,gas | 244.26 | J/mol×K | 636.10 | Joback Calculated Property |
| Cp,gas | 250.80 | J/mol×K | 665.94 | Joback Calculated Property |
| η | [0.0001689; 0.0232383] | Pa×s | [263.05; 486.89] |
|
| η | 0.0232383 | Pa×s | 263.05 | Joback Calculated Property |
| η | 0.0061439 | Pa×s | 300.36 | Joback Calculated Property |
| η | 0.0021795 | Pa×s | 337.66 | Joback Calculated Property |
| η | 0.0009502 | Pa×s | 374.97 | Joback Calculated Property |
| η | 0.0004814 | Pa×s | 412.28 | Joback Calculated Property |
| η | 0.0002731 | Pa×s | 449.58 | Joback Calculated Property |
| η | 0.0001689 | Pa×s | 486.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-3-Hexenoic acid.
Sources
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