- InChI
- InChI=1S/C15H26O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h6,10-11,14-16H,5,7-9H2,1-4H3/b12-6+,13-10-/t14-,15-/m0/s1
- InChI Key
- PXMCURAOQSNMOZ-ZDYWMRFRSA-N
- Formula
- C15H26O
- SMILES
- CC1=CC(O)C(C(C)C)CCC(C)=CCC1
- Molecular Weight1
- 222.37
- 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° | -54.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -408.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.99 | kJ/mol | Joback Calculated Property |
| log10WS | -4.60 | Crippen Calculated Property | |
| logPoct/wat | 4.086 | Crippen Calculated Property | |
| McVol | 208.620 | ml/mol | McGowan Calculated Property |
| Pc | 1985.89 | kPa | Joback Calculated Property |
| Inp | [1705.00; 1711.00] |
|
|
| Inp | 1711.00 | NIST | |
| Inp | 1705.00 | NIST | |
| I | [2326.00; 2326.00] |
|
|
| I | 2326.00 | NIST | |
| I | 2326.00 | NIST | |
| Tboil | 674.58 | K | Joback Calculated Property |
| Tc | 881.07 | K | Joback Calculated Property |
| Tfus | 320.25 | K | Joback Calculated Property |
| Vc | 0.760 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [599.13; 702.77] | J/mol×K | [674.58; 881.07] |
|
| Cp,gas | 599.13 | J/mol×K | 674.58 | Joback Calculated Property |
| Cp,gas | 619.44 | J/mol×K | 708.99 | Joback Calculated Property |
| Cp,gas | 638.54 | J/mol×K | 743.41 | Joback Calculated Property |
| Cp,gas | 656.42 | J/mol×K | 777.82 | Joback Calculated Property |
| Cp,gas | 673.09 | J/mol×K | 812.24 | Joback Calculated Property |
| Cp,gas | 688.54 | J/mol×K | 846.65 | Joback Calculated Property |
| Cp,gas | 702.77 | J/mol×K | 881.07 | Joback Calculated Property |
| η | [0.0000166; 0.0102052] | Pa×s | [320.25; 674.58] |
|
| η | 0.0102052 | Pa×s | 320.25 | Joback Calculated Property |
| η | 0.0015204 | Pa×s | 379.31 | Joback Calculated Property |
| η | 0.0003783 | Pa×s | 438.36 | Joback Calculated Property |
| η | 0.0001310 | Pa×s | 497.41 | Joback Calculated Property |
| η | 0.0000568 | Pa×s | 556.47 | Joback Calculated Property |
| η | 0.0000289 | Pa×s | 615.52 | Joback Calculated Property |
| η | 0.0000166 | Pa×s | 674.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Kunzeaol.
Sources
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