- InChI
- InChI=1S/C9H16O2/c1-3-4-5-6-7-9(11)8(2)10/h6-7,9,11H,3-5H2,1-2H3/b7-6+
- InChI Key
- XDBJTAHIGVPGTG-VOTSOKGWSA-N
- Formula
- C9H16O2
- SMILES
- CCCCC=CC(O)C(C)=O
- Molecular Weight1
- 156.22
- 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).
- 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° | -163.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -381.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.62 | kJ/mol | Joback Calculated Property |
| log10WS | -2.10 | Crippen Calculated Property | |
| logPoct/wat | 1.683 | Crippen Calculated Property | |
| McVol | 140.810 | ml/mol | McGowan Calculated Property |
| Pc | 2868.87 | kPa | Joback Calculated Property |
| I | 1776.00 | NIST | |
| Tboil | 555.09 | K | Joback Calculated Property |
| Tc | 732.68 | K | Joback Calculated Property |
| Tfus | 281.86 | K | Joback Calculated Property |
| Vc | 0.538 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [336.55; 397.55] | J/mol×K | [555.09; 732.68] | 
|
| Cp,gas | 336.55 | J/mol×K | 555.09 | Joback Calculated Property |
| Cp,gas | 348.01 | J/mol×K | 584.69 | Joback Calculated Property |
| Cp,gas | 358.93 | J/mol×K | 614.29 | Joback Calculated Property |
| Cp,gas | 369.32 | J/mol×K | 643.89 | Joback Calculated Property |
| Cp,gas | 379.20 | J/mol×K | 673.49 | Joback Calculated Property |
| Cp,gas | 388.61 | J/mol×K | 703.09 | Joback Calculated Property |
| Cp,gas | 397.55 | J/mol×K | 732.68 | Joback Calculated Property |
| η | [0.0000974; 0.0233418] | Pa×s | [281.86; 555.09] |
|
| η | 0.0233418 | Pa×s | 281.86 | Joback Calculated Property |
| η | 0.0049622 | Pa×s | 327.40 | Joback Calculated Property |
| η | 0.0015397 | Pa×s | 372.94 | Joback Calculated Property |
| η | 0.0006163 | Pa×s | 418.48 | Joback Calculated Property |
| η | 0.0002953 | Pa×s | 464.01 | Joback Calculated Property |
| η | 0.0001614 | Pa×s | 509.55 | Joback Calculated Property |
| η | 0.0000974 | Pa×s | 555.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-hydroxy-(E)-4-nonen-2-one.
Sources
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