- InChI
- InChI=1S/C15H24O/c1-6-14(4)10-8-12-15(5,16)11-7-9-13(2)3/h6,8-10,12,16H,1,7,11H2,2-5H3/b12-8-,14-10-
- InChI Key
- VJBVZYOKPWWGLN-HBMMGNRNSA-N
- Formula
- C15H24O
- SMILES
- C=CC(C)=CC=CC(C)(O)CCC=C(C)C
- Molecular Weight1
- 220.35
- Other Names
-
- 2,6,10-trimethyldodeca-2,7,9,11-tetraen-6-ol
- 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).
- 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° | 252.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -56.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.73 | kJ/mol | Joback Calculated Property |
| log10WS | -4.89 | Crippen Calculated Property | |
| logPoct/wat | 4.172 | Crippen Calculated Property | |
| McVol | 210.880 | ml/mol | McGowan Calculated Property |
| Pc | 1827.85 | kPa | Joback Calculated Property |
| I | [2273.00; 2294.00] |
|
|
| I | 2273.00 | NIST | |
| I | 2294.00 | NIST | |
| Tboil | 640.47 | K | Joback Calculated Property |
| Tc | 828.10 | K | Joback Calculated Property |
| Tfus | 277.13 | K | Joback Calculated Property |
| Vc | 0.806 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [554.13; 634.61] | J/mol×K | [640.47; 828.10] |
|
| Cp,gas | 554.13 | J/mol×K | 640.47 | Joback Calculated Property |
| Cp,gas | 569.45 | J/mol×K | 671.74 | Joback Calculated Property |
| Cp,gas | 583.91 | J/mol×K | 703.01 | Joback Calculated Property |
| Cp,gas | 597.58 | J/mol×K | 734.29 | Joback Calculated Property |
| Cp,gas | 610.54 | J/mol×K | 765.56 | Joback Calculated Property |
| Cp,gas | 622.86 | J/mol×K | 796.83 | Joback Calculated Property |
| Cp,gas | 634.61 | J/mol×K | 828.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Hydroxyfarnesen.
Sources
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