- InChI
- InChI=1S/C15H24O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,8-9,13,15-16H,6-7,10H2,1-4H3
- InChI Key
- AEQCSQRYHBNSGA-UHFFFAOYSA-N
- Formula
- C15H24O
- SMILES
- CC(C)=CC(O)CC(C)C1=CCC(C)=CC1
- Molecular Weight1
- 220.35
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | 78.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -241.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.57 | kJ/mol | Joback Calculated Property |
| log10WS | -4.69 | Crippen Calculated Property | |
| logPoct/wat | 4.006 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 2041.91 | kPa | Joback Calculated Property |
| Inp | 1577.00 | NIST | |
| Tboil | 670.44 | K | Joback Calculated Property |
| Tc | 867.98 | K | Joback Calculated Property |
| Tfus | 308.77 | K | Joback Calculated Property |
| Vc | 0.769 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [562.58; 648.63] | J/mol×K | [670.44; 867.98] | 
|
| Cp,gas | 562.58 | J/mol×K | 670.44 | Joback Calculated Property |
| Cp,gas | 579.06 | J/mol×K | 703.36 | Joback Calculated Property |
| Cp,gas | 594.62 | J/mol×K | 736.29 | Joback Calculated Property |
| Cp,gas | 609.32 | J/mol×K | 769.21 | Joback Calculated Property |
| Cp,gas | 623.18 | J/mol×K | 802.14 | Joback Calculated Property |
| Cp,gas | 636.27 | J/mol×K | 835.06 | Joback Calculated Property |
| Cp,gas | 648.63 | J/mol×K | 867.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Turmerol.
Sources
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