- InChI
- InChI=1S/C9H15ClO2/c1-2-3-4-8-12-9(11)6-5-7-10/h2H,1,3-8H2
- InChI Key
- WOJRNXZZPCTQQV-UHFFFAOYSA-N
- Formula
- C9H15ClO2
- SMILES
- C=CCCCOC(=O)CCCCl
- Molecular Weight1
- 190.67
- 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° | -133.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -364.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.50 | kJ/mol | Joback Calculated Property |
| log10WS | -2.46 | Crippen Calculated Property | |
| logPoct/wat | 2.515 | Crippen Calculated Property | |
| McVol | 153.050 | ml/mol | McGowan Calculated Property |
| Pc | 2424.27 | kPa | Joback Calculated Property |
| Inp | [1277.00; 1326.00] |
|
|
| Inp | 1326.00 | NIST | |
| Inp | 1277.00 | NIST | |
| Inp | 1298.00 | NIST | |
| Inp | 1303.00 | NIST | |
| I | [1851.00; 1892.00] |
|
|
| I | 1851.00 | NIST | |
| I | 1865.00 | NIST | |
| I | 1892.00 | NIST | |
| Tboil | 515.72 | K | Joback Calculated Property |
| Tc | 698.21 | K | Joback Calculated Property |
| Tfus | 291.51 | K | Joback Calculated Property |
| Vc | 0.594 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [333.64; 399.14] | J/mol×K | [515.72; 698.21] |
|
| Cp,gas | 333.64 | J/mol×K | 515.72 | Joback Calculated Property |
| Cp,gas | 345.83 | J/mol×K | 546.14 | Joback Calculated Property |
| Cp,gas | 357.50 | J/mol×K | 576.55 | Joback Calculated Property |
| Cp,gas | 368.66 | J/mol×K | 606.97 | Joback Calculated Property |
| Cp,gas | 379.31 | J/mol×K | 637.38 | Joback Calculated Property |
| Cp,gas | 389.47 | J/mol×K | 667.80 | Joback Calculated Property |
| Cp,gas | 399.14 | J/mol×K | 698.21 | Joback Calculated Property |
| η | [0.0002457; 0.0028034] | Pa×s | [291.51; 515.72] |
|
| η | 0.0028034 | Pa×s | 291.51 | Joback Calculated Property |
| η | 0.0014838 | Pa×s | 328.88 | Joback Calculated Property |
| η | 0.0008942 | Pa×s | 366.25 | Joback Calculated Property |
| η | 0.0005919 | Pa×s | 403.62 | Joback Calculated Property |
| η | 0.0004201 | Pa×s | 440.98 | Joback Calculated Property |
| η | 0.0003146 | Pa×s | 478.35 | Joback Calculated Property |
| η | 0.0002457 | Pa×s | 515.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanoic acid, 4-chloro, 4-pentenyl ester.
Sources
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