- InChI
- InChI=1S/C9H18O3/c1-11-9(12-2)7-5-3-4-6-8-10/h8-9H,3-7H2,1-2H3
- InChI Key
- ZSCWUFCWRFKZGG-UHFFFAOYSA-N
- Formula
- C9H18O3
- SMILES
- COC(CCCCCC=O)OC
- Molecular Weight1
- 174.24
- CAS
- 60090-77-9
- 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).
- 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° | -287.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -584.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.78 | kJ/mol | Joback Calculated Property |
| log10WS | -1.65 | Crippen Calculated Property | |
| logPoct/wat | 1.755 | Crippen Calculated Property | |
| McVol | 150.980 | ml/mol | McGowan Calculated Property |
| Pc | 2417.12 | kPa | Joback Calculated Property |
| Tboil | 498.38 | K | Joback Calculated Property |
| Tc | 670.88 | K | Joback Calculated Property |
| Tfus | 262.65 | K | Joback Calculated Property |
| Vc | 0.587 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [349.06; 420.71] | J/mol×K | [498.38; 670.88] | 
|
| Cp,gas | 349.06 | J/mol×K | 498.38 | Joback Calculated Property |
| Cp,gas | 362.11 | J/mol×K | 527.13 | Joback Calculated Property |
| Cp,gas | 374.72 | J/mol×K | 555.88 | Joback Calculated Property |
| Cp,gas | 386.89 | J/mol×K | 584.63 | Joback Calculated Property |
| Cp,gas | 398.61 | J/mol×K | 613.38 | Joback Calculated Property |
| Cp,gas | 409.89 | J/mol×K | 642.13 | Joback Calculated Property |
| Cp,gas | 420.71 | J/mol×K | 670.88 | Joback Calculated Property |
| η | [0.0002041; 0.0038602] | Pa×s | [262.65; 498.38] |
|
| η | 0.0038602 | Pa×s | 262.65 | Joback Calculated Property |
| η | 0.0017194 | Pa×s | 301.94 | Joback Calculated Property |
| η | 0.0009226 | Pa×s | 341.23 | Joback Calculated Property |
| η | 0.0005630 | Pa×s | 380.51 | Joback Calculated Property |
| η | 0.0003768 | Pa×s | 419.80 | Joback Calculated Property |
| η | 0.0002701 | Pa×s | 459.09 | Joback Calculated Property |
| η | 0.0002041 | Pa×s | 498.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptanal, 7,7-dimethoxy-.
Sources
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