- InChI
- InChI=1S/C12H24/c1-6-7-11(4)9-12(5)8-10(2)3/h11-12H,2,6-9H2,1,3-5H3
- InChI Key
- QFMQAIUZMMQKTB-UHFFFAOYSA-N
- Formula
- C12H24
- SMILES
- C=C(C)CC(C)CC(C)CCC
- Molecular Weight1
- 168.32
- CAS
- 55771-40-9
- 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° | 124.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -185.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.94 | kJ/mol | Joback Calculated Property |
| log10WS | -4.22 | Crippen Calculated Property | |
| logPoct/wat | 4.415 | Crippen Calculated Property | |
| McVol | 175.640 | ml/mol | McGowan Calculated Property |
| Pc | 1878.90 | kPa | Joback Calculated Property |
| Inp | [1080.00; 1080.00] |
|
|
| Inp | 1080.00 | NIST | |
| Inp | 1080.00 | NIST | |
| Tboil | 469.64 | K | Joback Calculated Property |
| Tc | 643.38 | K | Joback Calculated Property |
| Tfus | 179.28 | K | Joback Calculated Property |
| Vc | 0.677 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [389.06; 482.99] | J/mol×K | [469.64; 643.38] |
|
| Cp,gas | 389.06 | J/mol×K | 469.64 | Joback Calculated Property |
| Cp,gas | 406.47 | J/mol×K | 498.60 | Joback Calculated Property |
| Cp,gas | 423.15 | J/mol×K | 527.55 | Joback Calculated Property |
| Cp,gas | 439.12 | J/mol×K | 556.51 | Joback Calculated Property |
| Cp,gas | 454.41 | J/mol×K | 585.47 | Joback Calculated Property |
| Cp,gas | 469.02 | J/mol×K | 614.42 | Joback Calculated Property |
| Cp,gas | 482.99 | J/mol×K | 643.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,6-Trimethyl-1-nonene.
Sources
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