- InChI
- InChI=1S/C16H26/c1-6-9-15(4)12-8-13-16(5)11-7-10-14(2)3/h6,9-10,13H,1,7-8,11-12H2,2-5H3/b15-9+,16-13+
- InChI Key
- CWLVBFJCJXHUCF-RNPYNJAESA-N
- Formula
- C16H26
- SMILES
- C=CC=C(C)CCC=C(C)CCC=C(C)C
- Molecular Weight1
- 218.38
- Other Names
-
- (3E,7E)-4,8,12-Trimethyltrideca-1,3,7,11-tetraene
- 4,8,12-Trimethyl-1,3(E),7(E),11-tridecatetraene
- (E,E)-4,8,12-Trimethyltrideca-1,3,7,11-tetraene
- 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° | 386.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 74.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.65 | kJ/mol | Joback Calculated Property |
| log10WS | -5.93 | Crippen Calculated Property | |
| logPoct/wat | 5.592 | Crippen Calculated Property | |
| McVol | 219.100 | ml/mol | McGowan Calculated Property |
| Pc | 1548.78 | kPa | Joback Calculated Property |
| Inp | 1566.00 | NIST | |
| I | [1803.00; 1823.00] |
|
|
| I | 1803.00 | NIST | |
| I | 1808.00 | NIST | |
| I | 1823.00 | NIST | |
| Tboil | 574.28 | K | Joback Calculated Property |
| Tc | 762.61 | K | Joback Calculated Property |
| Tfus | 211.20 | K | Joback Calculated Property |
| Vc | 0.856 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [534.91; 632.89] | J/mol×K | [574.28; 762.61] |
|
| Cp,gas | 534.91 | J/mol×K | 574.28 | Joback Calculated Property |
| Cp,gas | 553.50 | J/mol×K | 605.67 | Joback Calculated Property |
| Cp,gas | 571.11 | J/mol×K | 637.06 | Joback Calculated Property |
| Cp,gas | 587.78 | J/mol×K | 668.44 | Joback Calculated Property |
| Cp,gas | 603.60 | J/mol×K | 699.83 | Joback Calculated Property |
| Cp,gas | 618.61 | J/mol×K | 731.22 | Joback Calculated Property |
| Cp,gas | 632.89 | J/mol×K | 762.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E,E)-4,8,12-trimethyl-1,3,7,11-tridecatetraene.
Sources
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