- InChI
- InChI=1S/C20H34O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,11,13,15,21H,1,8-10,12,14,16H2,2-6H3/b18-13+,19-15+
- InChI Key
- IQDXAJNQKSIPGB-HQSZAHFGSA-N
- Formula
- C20H34O
- SMILES
-
C=CC(C)(O)CCC=C(C)CCC=C(C)CCC=
C(C)C - Molecular Weight1
- 290.48
- CAS
- 1113-21-9
- Other Names
-
- Geranyl linallol
- Geranyllinalool
- Linalool, geranyl-
- (E,E)-Geranyllinalool
- Geranyllinalol
- (E,E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-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).
- 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° | 286.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -169.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.94 | kJ/mol | Joback Calculated Property |
| log10WS | -6.98 | Crippen Calculated Property | |
| logPoct/wat | 6.123 | Crippen Calculated Property | |
| McVol | 281.330 | ml/mol | McGowan Calculated Property |
| Pc | 1262.85 | kPa | Joback Calculated Property |
| Inp | [2008.00; 2034.00] |
|
|
| Inp | 2020.00 | NIST | |
| Inp | 2034.00 | NIST | |
| Inp | 2008.00 | NIST | |
| Inp | 2031.00 | NIST | |
| Inp | 2010.00 | NIST | |
| Inp | 2020.00 | NIST | |
| Inp | 2020.00 | NIST | |
| Inp | 2034.00 | NIST | |
| I | [2491.00; 2559.00] |
|
|
| I | 2491.00 | NIST | |
| I | 2492.00 | NIST | |
| I | 2522.00 | NIST | |
| I | 2559.00 | NIST | |
| I | 2537.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2559.00 | NIST | |
| I | 2551.00 | NIST | |
| I | 2522.00 | NIST | |
| I | 2491.00 | NIST | |
| Tboil | 754.75 | K | Joback Calculated Property |
| Tc | 940.55 | K | Joback Calculated Property |
| Tfus | 319.52 | K | Joback Calculated Property |
| Vc | 1.087 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [830.45; 924.18] | J/mol×K | [754.75; 940.55] |
|
| Cp,gas | 830.45 | J/mol×K | 754.75 | Joback Calculated Property |
| Cp,gas | 847.86 | J/mol×K | 785.72 | Joback Calculated Property |
| Cp,gas | 864.44 | J/mol×K | 816.68 | Joback Calculated Property |
| Cp,gas | 880.28 | J/mol×K | 847.65 | Joback Calculated Property |
| Cp,gas | 895.46 | J/mol×K | 878.62 | Joback Calculated Property |
| Cp,gas | 910.07 | J/mol×K | 909.59 | Joback Calculated Property |
| Cp,gas | 924.18 | J/mol×K | 940.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,6,10,14-Hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-, (E,E)-.
Sources
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