- InChI
- InChI=1S/C9H14O2/c1-4-6-9(7-5-2)11-8(3)10/h4-5,9H,1-2,6-7H2,3H3
- InChI Key
- GGOHGGVWCJPFTK-UHFFFAOYSA-N
- Formula
- C9H14O2
- SMILES
- C=CCC(CC=C)OC(C)=O
- Molecular Weight1
- 154.21
- 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.
- 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° | -35.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -228.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.06 | kJ/mol | Joback Calculated Property |
| log10WS | -2.27 | Crippen Calculated Property | |
| logPoct/wat | 2.070 | Crippen Calculated Property | |
| McVol | 136.510 | ml/mol | McGowan Calculated Property |
| Pc | 2646.11 | kPa | Joback Calculated Property |
| Inp | [986.00; 986.00] |
|
|
| Inp | 986.00 | NIST | |
| Inp | 986.00 | NIST | |
| Tboil | 474.53 | K | Joback Calculated Property |
| Tc | 658.99 | K | Joback Calculated Property |
| Tfus | 244.83 | K | Joback Calculated Property |
| Vc | 0.519 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [288.35; 355.04] | J/mol×K | [474.53; 658.99] |
|
| Cp,gas | 288.35 | J/mol×K | 474.53 | Joback Calculated Property |
| Cp,gas | 300.77 | J/mol×K | 505.27 | Joback Calculated Property |
| Cp,gas | 312.66 | J/mol×K | 536.02 | Joback Calculated Property |
| Cp,gas | 324.01 | J/mol×K | 566.76 | Joback Calculated Property |
| Cp,gas | 334.85 | J/mol×K | 597.50 | Joback Calculated Property |
| Cp,gas | 345.19 | J/mol×K | 628.25 | Joback Calculated Property |
| Cp,gas | 355.04 | J/mol×K | 658.99 | Joback Calculated Property |
| η | [0.0002316; 0.0039424] | Pa×s | [244.83; 474.53] |
|
| η | 0.0039424 | Pa×s | 244.83 | Joback Calculated Property |
| η | 0.0017860 | Pa×s | 283.11 | Joback Calculated Property |
| η | 0.0009770 | Pa×s | 321.40 | Joback Calculated Property |
| η | 0.0006077 | Pa×s | 359.68 | Joback Calculated Property |
| η | 0.0004142 | Pa×s | 397.96 | Joback Calculated Property |
| η | 0.0003019 | Pa×s | 436.25 | Joback Calculated Property |
| η | 0.0002316 | Pa×s | 474.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,6-Heptadien-4-ol, acetate.
Sources
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