- InChI
- InChI=1S/C15H22O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h4,6,8,11-12,14,16H,5,7,9H2,1-3H3/t11-,12?,14+/m1/s1
- InChI Key
- SGUPEDLSWUIQIJ-SOGVLRHJSA-N
- Formula
- C15H22O
- SMILES
- Cc1ccc2c(c1)C(C(C)CO)CCC2C
- Molecular Weight1
- 218.33
- 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).
- 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° | 70.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -250.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.65 | kJ/mol | Joback Calculated Property |
| log10WS | -4.07 | Crippen Calculated Property | |
| logPoct/wat | 3.604 | Crippen Calculated Property | |
| McVol | 193.460 | ml/mol | McGowan Calculated Property |
| Pc | 2193.84 | kPa | Joback Calculated Property |
| I | [2694.00; 2694.00] |
|
|
| I | 2694.00 | NIST | |
| I | 2694.00 | NIST | |
| Tboil | 677.32 | K | Joback Calculated Property |
| Tc | 880.91 | K | Joback Calculated Property |
| Tfus | 366.27 | K | Joback Calculated Property |
| Vc | 0.729 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [550.83; 638.18] | J/mol×K | [677.32; 880.91] |
|
| Cp,gas | 550.83 | J/mol×K | 677.32 | Joback Calculated Property |
| Cp,gas | 567.70 | J/mol×K | 711.25 | Joback Calculated Property |
| Cp,gas | 583.59 | J/mol×K | 745.18 | Joback Calculated Property |
| Cp,gas | 598.53 | J/mol×K | 779.11 | Joback Calculated Property |
| Cp,gas | 612.58 | J/mol×K | 813.04 | Joback Calculated Property |
| Cp,gas | 625.78 | J/mol×K | 846.98 | Joback Calculated Property |
| Cp,gas | 638.18 | J/mol×K | 880.91 | Joback Calculated Property |
| η | [0.0000931; 0.0033634] | Pa×s | [366.27; 677.32] |
|
| η | 0.0033634 | Pa×s | 366.27 | Joback Calculated Property |
| η | 0.0012769 | Pa×s | 418.11 | Joback Calculated Property |
| η | 0.0006003 | Pa×s | 469.95 | Joback Calculated Property |
| η | 0.0003278 | Pa×s | 521.80 | Joback Calculated Property |
| η | 0.0001997 | Pa×s | 573.64 | Joback Calculated Property |
| η | 0.0001321 | Pa×s | 625.48 | Joback Calculated Property |
| η | 0.0000931 | Pa×s | 677.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 14-hydroxy-calamenene.
Sources
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