- InChI
- InChI=1S/C15H22O2/c1-14(2,3)10-15(4,5)12-6-7-13(17)11(8-12)9-16/h6-9,17H,10H2,1-5H3
- InChI Key
- PRQGLXVKXBBFHU-UHFFFAOYSA-N
- Formula
- C15H22O2
- SMILES
-
CC(C)(C)CC(C)(C)c1ccc(O)c(C=O)
c1 - Molecular Weight1
- 234.33
- 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° | -70.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -408.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.06 | kJ/mol | Joback Calculated Property |
| log10WS | -4.01 | Crippen Calculated Property | |
| logPoct/wat | 3.919 | Crippen Calculated Property | |
| McVol | 205.890 | ml/mol | McGowan Calculated Property |
| Pc | 2309.17 | kPa | Joback Calculated Property |
| Inp | 1879.00 | NIST | |
| Tboil | 697.08 | K | Joback Calculated Property |
| Tc | 924.32 | K | Joback Calculated Property |
| Tfus | 456.31 | K | Joback Calculated Property |
| Vc | 0.729 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [582.43; 664.69] | J/mol×K | [697.08; 924.32] | 
|
| Cp,gas | 582.43 | J/mol×K | 697.08 | Joback Calculated Property |
| Cp,gas | 598.34 | J/mol×K | 734.95 | Joback Calculated Property |
| Cp,gas | 613.17 | J/mol×K | 772.83 | Joback Calculated Property |
| Cp,gas | 627.08 | J/mol×K | 810.70 | Joback Calculated Property |
| Cp,gas | 640.21 | J/mol×K | 848.57 | Joback Calculated Property |
| Cp,gas | 652.70 | J/mol×K | 886.44 | Joback Calculated Property |
| Cp,gas | 664.69 | J/mol×K | 924.32 | Joback Calculated Property |
| η | [0.0000123; 0.0004992] | Pa×s | [456.31; 697.08] |
|
| η | 0.0004992 | Pa×s | 456.31 | Joback Calculated Property |
| η | 0.0002099 | Pa×s | 496.44 | Joback Calculated Property |
| η | 0.0001004 | Pa×s | 536.57 | Joback Calculated Property |
| η | 0.0000533 | Pa×s | 576.70 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 616.82 | Joback Calculated Property |
| η | 0.0000189 | Pa×s | 656.95 | Joback Calculated Property |
| η | 0.0000123 | Pa×s | 697.08 | Joback Calculated Property |
Similar Compounds
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Sources
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